N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide
TL;DR: N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide (CAS 320740-75-8) is a chemical compound with molecular formula C13H17N3OS and molecular weight 263.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-methylsulfanylbenzimidazole-1-carboxamide
Also Known As: N-butyl(2-methylthiobenzimidazolyl)carboxamide, N-butyl-2-methylsulfanylbenzimidazole-1-carboxamide, 2-Methylsulfanyl-benzoimidazole-1-carboxylic acid butylamide, N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide, N-butyl-2-(methylthio)-1H-benzo[d]imidazole-1-carboxamide
| Molecular Formula | C13H17N3OS |
|---|---|
| Molecular Weight | 263.11 g/mol |
| LogP | 3.116 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.10922 |
| Heavy Atoms | 18 |
| Complexity | 550.16 |
Chemical Identifiers
| CAS Number | 320740-75-8 |
|---|---|
| SMILES | CCCCNC(=O)N1C2=CC=CC=C2N=C1SC |
Product Overview
N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide (CAS 320740-75-8), with molecular formula C13H17N3OS and molecular weight 263.11 g/mol. IUPAC: N-butyl-2-methylsulfanylbenzimidazole-1-carboxamide.
Chemical Property Profile of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide
Property Insights of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide
The XLogP value of 3.116 indicates that N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide has 1 hydrogen bond donor(s) and 3 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-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide?
The CAS number of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide is 320740-75-8.
What is the molecular formula of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide?
The molecular formula of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide is C13H17N3OS.
What is the molecular weight of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide?
The molecular weight of N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide is 263.11 g/mol.
Where can I buy N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide?
You can request a quote for N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-2-(methylsulfanyl)-1H-benzimidazole-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.