CS-0129865
(3S,6S,11bR)-6-((tert-Butoxycarbonyl)amino)-5-oxo-2,3,5,6,7,11b-hexahydro-1H-benzo[c]pyrrolo[1,2-a]azepine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: None
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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
C₁₉H₂₄N₂O₅
Molecular Weight
360.40
Synonyms
None
SMILES
O=C1[C@@H](NC(OC(C)(C)C)=O)CC2=C(C=CC=C2)[C@@H]3N1[C@H](C(O)=O)CC3
Tpsa
95.94
Logp
2.2527
H Acceptors
4
H Donors
2
Rotatable Bonds
2
Other Options
...
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: C₁₉H₂₄N₂O₅
Molecular Weight: 360.40
Synonyms: None
SMILES: O=C1[C@@H](NC(OC(C)(C)C)=O)CC2=C(C=CC=C2)[C@@H]3N1[C@H](C(O)=O)CC3
Tpsa: 95.94
Logp: 2.2527
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₄N₂O₅
Molecular Weight:
360.40
Synonyms:
None
SMILES:
O=C1[C@@H](NC(OC(C)(C)C)=O)CC2=C(C=CC=C2)[C@@H]3N1[C@H](C(O)=O)CC3
Tpsa:
95.94
Logp:
2.2527
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₆N₆O₄S₃
Molecular Weight: 510.65
Synonyms: None
SMILES: NC1=NC(S[C@H](C)C(N=C2C(C=C3OCCNS(=O)(C)=O)=CC=C3OC)=C(S2)C)=NC(N)=C1
Tpsa: 155.34
Logp: 2.86282
H Acceptors: 11
H Donors: 3
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₆N₆O₄S₃
Molecular Weight:
510.65
Synonyms:
None
SMILES:
NC1=NC(S[C@H](C)C(N=C2C(C=C3OCCNS(=O)(C)=O)=CC=C3OC)=C(S2)C)=NC(N)=C1
Tpsa:
155.34
Logp:
2.86282
H Acceptors:
11
H Donors:
3
Rotatable Bonds:
10
Purity: 98%
MDL No: MFCD28397262
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆ClNO₅
Molecular Weight: 231.59
Synonyms: None
SMILES: O=C(OC)C1=CC([N+]([O-])=O)=C(Cl)C(O)=C1
Tpsa: 89.67
Logp: 1.7404
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28397262
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆ClNO₅
Molecular Weight:
231.59
Synonyms:
None
SMILES:
O=C(OC)C1=CC([N+]([O-])=O)=C(Cl)C(O)=C1
Tpsa:
89.67
Logp:
1.7404
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: MFCD00077968
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂O₄
Molecular Weight: 172.18
Synonyms: trans-2-Butene-1,4-dioldiacetate
SMILES: CC(OC/C=C/COC(C)=O)=O
Tpsa: 52.6
Logp: 1.3049
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
95%
MDL No:
MFCD00077968
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂O₄
Molecular Weight:
172.18
Synonyms:
trans-2-Butene-1,4-dioldiacetate
SMILES:
CC(OC/C=C/COC(C)=O)=O
Tpsa:
52.6
Logp:
1.3049
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4