CS-0010196
(3S,3'S,4'R,6'R,8'S,8'aR)-6-Chloro-8'-(3-chloro-2-fluorophenyl)-6'-(2,2-dimethylpropyl)-3',4',8',8'a-tetrahydro-3',4'-diphenylspiro[3H-indole-3,7'(6'H)-[1H]pyrrolo[2,1-c][1,4]oxazine]-1',2(1H)-dione
Manufacturer: ChemScene
CAS Number: 897365-81-0
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₇H₃₃Cl₂FN₂O₃
Molecular Weight
643.57
Synonyms
(3S,3'S,4'R,6'R,8'S,8'aR)-6-chloro-8'-(3-chloro-2-fluorophenyl)-6'-(2,2-dimethylpropyl)-3',4'-diphenylspiro[1H-indole-3,7'-4,6,8,8a-tetrahydro-3H-pyrrolo[2,1-c][1,4]oxazine]-1',2-dione
SMILES
CC(C)(C)C[C@@H]1[C@@]2(C3=CC=C(Cl)C=C3NC2=O)[C@@H](C4=CC=CC(Cl)=C4F)[C@H]5N1[C@H](C6=CC=CC=C6)[C@H](C7=CC=CC=C7)OC5=O
Tpsa
58.64
Logp
8.6346
H Acceptors
4
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 897365-81-0 | (3S,3'S,4'R,6'R,8'S,8'aR)-6-chloro-8'-(3-chloro-2-fluorophenyl)-6'-(2,2-dimethylpropyl)-3',4'-diphenylspiro[1H-indole-3,7'-4,6,8,8a-tetrahydro-3H-pyrrolo[2,1-c][1,4]oxazine]-1',2-dione | A2B Chem | -- |
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₃₃Cl₂FN₂O₃
Molecular Weight: 643.57
Synonyms: (3S,3'S,4'R,6'R,8'S,8'aR)-6-chloro-8'-(3-chloro-2-fluorophenyl)-6'-(2,2-dimethylpropyl)-3',4'-diphenylspiro[1H-indole-3,7'-4,6,8,8a-tetrahydro-3H-pyrrolo[2,1-c][1,4]oxazine]-1',2-dione
SMILES: CC(C)(C)C[C@@H]1[C@@]2(C3=CC=C(Cl)C=C3NC2=O)[C@@H](C4=CC=CC(Cl)=C4F)[C@H]5N1[C@H](C6=CC=CC=C6)[C@H](C7=CC=CC=C7)OC5=O
Tpsa: 58.64
Logp: 8.6346
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₇H₃₃Cl₂FN₂O₃
Molecular Weight:
643.57
Synonyms:
(3S,3'S,4'R,6'R,8'S,8'aR)-6-chloro-8'-(3-chloro-2-fluorophenyl)-6'-(2,2-dimethylpropyl)-3',4'-diphenylspiro[1H-indole-3,7'-4,6,8,8a-tetrahydro-3H-pyrrolo[2,1-c][1,4]oxazine]-1',2-dione
SMILES:
CC(C)(C)C[C@@H]1[C@@]2(C3=CC=C(Cl)C=C3NC2=O)[C@@H](C4=CC=CC(Cl)=C4F)[C@H]5N1[C@H](C6=CC=CC=C6)[C@H](C7=CC=CC=C7)OC5=O
Tpsa:
58.64
Logp:
8.6346
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD28387169
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₃₆F₃N₃O₆
Molecular Weight: 567.60
Synonyms: None
SMILES: O=C([C@@H](NC([C@H](CC(C)C)NC([C@@H](N)CCC1=CC=CC=C1)=O)=O)CC2=CC=CC=C2)OC.FC(F)(C(O)=O)F
Tpsa: 147.82
Logp: 3.0112
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 12
Purity:
98%
MDL No:
MFCD28387169
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₆F₃N₃O₆
Molecular Weight:
567.60
Synonyms:
None
SMILES:
O=C([C@@H](NC([C@H](CC(C)C)NC([C@@H](N)CCC1=CC=CC=C1)=O)=O)CC2=CC=CC=C2)OC.FC(F)(C(O)=O)F
Tpsa:
147.82
Logp:
3.0112
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
12
Purity: 97%
MDL No: MFCD00083335
Storage: 4°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₁₆O
Molecular Weight: 296.37
Synonyms: 2,8-Dimethylnaphtho[3,2,1-kl]xanthene
SMILES: CC1=C2C3=C(C=C1)OC4=C(C=C(C)C=C4)C3=C5C=CC=CC5=C2
Tpsa: 9.23
Logp: 6.38254
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
MFCD00083335
Storage:
4°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₁₆O
Molecular Weight:
296.37
Synonyms:
2,8-Dimethylnaphtho[3,2,1-kl]xanthene
SMILES:
CC1=C2C3=C(C=C1)OC4=C(C=C(C)C=C4)C3=C5C=CC=CC5=C2
Tpsa:
9.23
Logp:
6.38254
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD28015936
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₃₂N₂O₆S₂
Molecular Weight: 544.68
Synonyms: Xylene Blue; C.I. Acid Blue 1
SMILES: CC/[N+](CC)=C1C=C/C(C=C/1)=C(C2=CC=C(N(CC)CC)C=C2)\C3=CC=C(S(=O)([O-])=O)C=C3S(=O)(O)=O
Tpsa: 117.82
Logp: 4.1048
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 9
Purity:
98%
MDL No:
MFCD28015936
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₃₂N₂O₆S₂
Molecular Weight:
544.68
Synonyms:
Xylene Blue; C.I. Acid Blue 1
SMILES:
CC/[N+](CC)=C1C=C/C(C=C/1)=C(C2=CC=C(N(CC)CC)C=C2)\C3=CC=C(S(=O)([O-])=O)C=C3S(=O)(O)=O
Tpsa:
117.82
Logp:
4.1048
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
9