CS-0611298
(S)-4-(3-Bromophenyl)-6,8-dichloro-2-methyl-1,2,3,4-tetrahydroisoquinoline (2S,3S)-2,3-bis((4-methylbenzoyl)oxy)succinate
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
C₃₆H₃₂BrCl₂NO₈
Molecular Weight
757.45
Synonyms
None
SMILES
O=C(O[C@H](C(O)=O)[C@@H](C(O)=O)OC(C1=CC=C(C)C=C1)=O)C2=CC=C(C)C=C2.ClC3=CC(Cl)=C(CN(C)C[C@H]4C5=CC(Br)=CC=C5)C4=C3
Tpsa
130.44
Logp
7.55684
H Acceptors
7
H Donors
2
Rotatable Bonds
8
Other Options
...
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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: C₃₆H₃₂BrCl₂NO₈
Molecular Weight: 757.45
Synonyms: None
SMILES: O=C(O[C@H](C(O)=O)[C@@H](C(O)=O)OC(C1=CC=C(C)C=C1)=O)C2=CC=C(C)C=C2.ClC3=CC(Cl)=C(CN(C)C[C@H]4C5=CC(Br)=CC=C5)C4=C3
Tpsa: 130.44
Logp: 7.55684
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₆H₃₂BrCl₂NO₈
Molecular Weight:
757.45
Synonyms:
None
SMILES:
O=C(O[C@H](C(O)=O)[C@@H](C(O)=O)OC(C1=CC=C(C)C=C1)=O)C2=CC=C(C)C=C2.ClC3=CC(Cl)=C(CN(C)C[C@H]4C5=CC(Br)=CC=C5)C4=C3
Tpsa:
130.44
Logp:
7.55684
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: polypeptide, sealed storage, away from moisture and light, under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅₄H₂₂₆N₃₈O₅₂
Molecular Weight: 3441.67
Synonyms: None
SMILES: OC(C=C1)=CC=C1C[C@H](NC([C@H](CCCCN)NC([C@H](CO)NC([C@@H](NC([C@H](CC(O)=O)NC([C@H](CO)NC([C@H]([C@H](O)C)NC([C@@H](NC([C@H]([C@H](O)C)NC(CNC([C@H](CCC(N)=O)NC([C@H](CO)NC([C@@H](N)CC2=CN=CN2)=O)=O)=O)=O)=O)CC3=CC=CC=C3)=O)=O)=O)=O)CC4=CC=C(C=C4)O)=O)=O)=O)C(N[C@@H](CC(C)C)C(N[C@@H](CC(O)=O)C(NC(C)(C)C(N[C@@H](C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCC(O)=O)C(N[C@@H](CC5=CC=CC=C5)C(N[C@@H](C(C)C)C(N[C@@H](CCCCN)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CCC(O)=O)C(N[C@@H](CO)C(N[C@H](C(O)=O)[C@H](O)C)=O)=O)=O)=O)CC6=CNC7=CC=CC=C67)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O.CC(O)=O
Tpsa: 1485.49
Logp: -14.593
H Acceptors: 50
H Donors: 53
Rotatable Bonds: 109
Purity:
98%
MDL No:
None
Storage:
polypeptide, sealed storage, away from moisture and light, under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅₄H₂₂₆N₃₈O₅₂
Molecular Weight:
3441.67
Synonyms:
None
SMILES:
OC(C=C1)=CC=C1C[C@H](NC([C@H](CCCCN)NC([C@H](CO)NC([C@@H](NC([C@H](CC(O)=O)NC([C@H](CO)NC([C@H]([C@H](O)C)NC([C@@H](NC([C@H]([C@H](O)C)NC(CNC([C@H](CCC(N)=O)NC([C@H](CO)NC([C@@H](N)CC2=CN=CN2)=O)=O)=O)=O)=O)CC3=CC=CC=C3)=O)=O)=O)=O)CC4=CC=C(C=C4)O)=O)=O)=O)C(N[C@@H](CC(C)C)C(N[C@@H](CC(O)=O)C(NC(C)(C)C(N[C@@H](C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCC(O)=O)C(N[C@@H](CC5=CC=CC=C5)C(N[C@@H](C(C)C)C(N[C@@H](CCCCN)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CCC(O)=O)C(N[C@@H](CO)C(N[C@H](C(O)=O)[C@H](O)C)=O)=O)=O)=O)CC6=CNC7=CC=CC=C67)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O.CC(O)=O
Tpsa:
1485.49
Logp:
-14.593
H Acceptors:
50
H Donors:
53
Rotatable Bonds:
109
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₃BN₄O₆
Molecular Weight: 378.19
Synonyms: None
SMILES: O=C(N(C1=NN2C=CC(B(O)O)=CC2=N1)C(OC(C)(C)C)=O)OC(C)(C)C
Tpsa: 126.49
Logp: 1.0857
H Acceptors: 9
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:
C₁₆H₂₃BN₄O₆
Molecular Weight:
378.19
Synonyms:
None
SMILES:
O=C(N(C1=NN2C=CC(B(O)O)=CC2=N1)C(OC(C)(C)C)=O)OC(C)(C)C
Tpsa:
126.49
Logp:
1.0857
H Acceptors:
9
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: C₁₅H₂₂FNO₃
Molecular Weight: 283.34
Synonyms: None
SMILES: O=C(OC(C)(C)C)NCC(C)(O)CC1=CC=C(F)C=C1
Tpsa: 58.56
Logp: 2.6439
H Acceptors: 3
H Donors: 2
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:
C₁₅H₂₂FNO₃
Molecular Weight:
283.34
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NCC(C)(O)CC1=CC=C(F)C=C1
Tpsa:
58.56
Logp:
2.6439
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4