N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide
TL;DR: N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide (CAS 849902-61-0) is a chemical compound with molecular formula C18H22N4OS and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide
Also Known As: N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide, N-(1-cyano-1,2-dimethylpropyl)-2-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]sulfanyl}acetamide, N-(2-cyano-3-methyl-butan-2-yl)-2-(1-prop-2-enylbenzoimidazol-2-yl)sulfanyl-acetamide
| Molecular Formula | C18H22N4OS |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 3.36888 |
| Topological Polar Surface Area | 70.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 342.15143 |
| Heavy Atoms | 24 |
| Complexity | 789.90295 |
Chemical Identifiers
| CAS Number | 849902-61-0 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NC2=CC=CC=C2N1CC=C |
Product Overview
N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide (CAS 849902-61-0), with molecular formula C18H22N4OS and molecular weight 342.15 g/mol. IUPAC: N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide.
Chemical Property Profile of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide
Property Insights of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide
The XLogP value of 3.36888 indicates that N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.71 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide. Following Lipinski's Rule of Five, N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide has 1 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 N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide?
The CAS number of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide is 849902-61-0.
What is the molecular formula of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide?
The molecular formula of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide is C18H22N4OS.
What is the molecular weight of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide?
The molecular weight of N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide is 342.15 g/mol.
Where can I buy N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide?
You can request a quote for N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-cyano-3-methylbutan-2-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.