![2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide structure](/static/products/850/850029-87-7.png)
2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide
TL;DR: 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide (CAS 850029-87-7) is a chemical compound with molecular formula C17H19ClN4OS and molecular weight 362.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide
Also Known As: 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide, 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide, 2-[(6-chloro-1H-benzoimidazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide
| Molecular Formula | C17H19ClN4OS |
|---|---|
| Molecular Weight | 362.10 g/mol |
| LogP | 4.03958 |
| Topological Polar Surface Area | 81.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.0968 |
| Heavy Atoms | 24 |
| Complexity | 791.47473 |
Chemical Identifiers
| CAS Number | 850029-87-7 |
|---|---|
| SMILES | CC(C(=O)NC1(CCCCC1)C#N)SC2=NC3=C(N2)C=C(C=C3)Cl |
Product Overview
2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide (CAS 850029-87-7), with molecular formula C17H19ClN4OS and molecular weight 362.10 g/mol. IUPAC: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide.
Chemical Property Profile of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide
Property Insights of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide
The XLogP value of 4.03958 indicates that 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide. Following Lipinski's Rule of Five, 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide?
The CAS number of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide is 850029-87-7.
What is the molecular formula of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide?
The molecular formula of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide is C17H19ClN4OS.
What is the molecular weight of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide?
The molecular weight of 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide is 362.10 g/mol.
Where can I buy 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide?
You can request a quote for 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.