CS-0114121
tert-Butyl ((1r,4r)-4-(3-chloro-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamido)cyclohexyl)(methyl)carbamate
Manufacturer: ChemScene
CAS Number: 1060978-44-0
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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
C₃₃H₃₆ClN₃O₃S
Molecular Weight
590.18
Synonyms
Carbamic acid, N-[trans-4-[[(3-chlorobenzo[b]thien-2-yl)carbonyl][[3-(4-pyridinyl)phenyl]methyl]amino]cyclohexyl]-N-methyl-, 1,1-dimethylethyl ester
SMILES
O=C(OC(C)(C)C)N([C@H]1CC[C@H](N(C(C2=C(Cl)C3=CC=CC=C3S2)=O)CC4=CC=CC(C5=CC=NC=C5)=C4)CC1)C
Tpsa
62.74
Logp
8.4372
H Acceptors
5
H Donors
0
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1060978-44-0 | tert-Butyl ((1r,4r)-4-(3-chloro-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamido)cyclohexyl)(methyl)carbamate | 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: C₃₃H₃₆ClN₃O₃S
Molecular Weight: 590.18
Synonyms: Carbamic acid, N-[trans-4-[[(3-chlorobenzo[b]thien-2-yl)carbonyl][[3-(4-pyridinyl)phenyl]methyl]amino]cyclohexyl]-N-methyl-, 1,1-dimethylethyl ester
SMILES: O=C(OC(C)(C)C)N([C@H]1CC[C@H](N(C(C2=C(Cl)C3=CC=CC=C3S2)=O)CC4=CC=CC(C5=CC=NC=C5)=C4)CC1)C
Tpsa: 62.74
Logp: 8.4372
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₃H₃₆ClN₃O₃S
Molecular Weight:
590.18
Synonyms:
Carbamic acid, N-[trans-4-[[(3-chlorobenzo[b]thien-2-yl)carbonyl][[3-(4-pyridinyl)phenyl]methyl]amino]cyclohexyl]-N-methyl-, 1,1-dimethylethyl ester
SMILES:
O=C(OC(C)(C)C)N([C@H]1CC[C@H](N(C(C2=C(Cl)C3=CC=CC=C3S2)=O)CC4=CC=CC(C5=CC=NC=C5)=C4)CC1)C
Tpsa:
62.74
Logp:
8.4372
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
6
Purity: 95%
MDL No: MFCD02682374
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₂N₂O₄
Molecular Weight: 318.37
Synonyms: BOC-5-METHYL-DL-TRYPTOPHAN
SMILES: O=C(O)C(CC1=CNC2=C1C=C(C)C=C2)NC(OC(C)(C)C)=O
Tpsa: 91.42
Logp: 2.99672
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 4
Purity:
95%
MDL No:
MFCD02682374
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₂N₂O₄
Molecular Weight:
318.37
Synonyms:
BOC-5-METHYL-DL-TRYPTOPHAN
SMILES:
O=C(O)C(CC1=CNC2=C1C=C(C)C=C2)NC(OC(C)(C)C)=O
Tpsa:
91.42
Logp:
2.99672
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD22572661
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₉H₅₁N₅O₈S
Molecular Weight: 749.92
Synonyms: None
SMILES: O=C(NCCOCCOCCOCCOCCC(NCCC(N1C2=CC=CC=C2C#CC3=CC=CC=C3C1)=O)=O)CCCC[C@@H]4SC[C@]([C@]4([H])N5)([H])NC5=O
Tpsa: 156.56
Logp: 2.7378
H Acceptors: 9
H Donors: 4
Rotatable Bonds: 23
Purity:
98%
MDL No:
MFCD22572661
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₅₁N₅O₈S
Molecular Weight:
749.92
Synonyms:
None
SMILES:
O=C(NCCOCCOCCOCCOCCC(NCCC(N1C2=CC=CC=C2C#CC3=CC=CC=C3C1)=O)=O)CCCC[C@@H]4SC[C@]([C@]4([H])N5)([H])NC5=O
Tpsa:
156.56
Logp:
2.7378
H Acceptors:
9
H Donors:
4
Rotatable Bonds:
23
Purity: 98%
MDL No: MFCD28122948
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₃₅N₅O₇S₂
Molecular Weight: 653.77
Synonyms: None
SMILES: O=S(C(CNC(CCCC[C@@H]1SC[C@]([C@]1([H])N2)([H])NC2=O)=O)C(NCCC(N3C4=CC=CC=C4C#CC5=CC=CC=C5C3)=O)=O)(O)=O
Tpsa: 174.01
Logp: 1.5377
H Acceptors: 7
H Donors: 5
Rotatable Bonds: 12
Purity:
98%
MDL No:
MFCD28122948
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₅N₅O₇S₂
Molecular Weight:
653.77
Synonyms:
None
SMILES:
O=S(C(CNC(CCCC[C@@H]1SC[C@]([C@]1([H])N2)([H])NC2=O)=O)C(NCCC(N3C4=CC=CC=C4C#CC5=CC=CC=C5C3)=O)=O)(O)=O
Tpsa:
174.01
Logp:
1.5377
H Acceptors:
7
H Donors:
5
Rotatable Bonds:
12