N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide
TL;DR: N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide (CAS 713098-28-3) is a chemical compound with molecular formula C16H20N4O3S and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide
Also Known As: N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide, N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide, N-cycloheptyl-2-[(5-nitro-1H-benzimidazol-2-yl)thio]acetamide, N-cycloheptyl-2-(5-nitrobenzimidazol-2-ylthio)acetamide, N-cycloheptyl-2-((5-nitro-1H-benzo[d]imidazol-2-yl)thio)acetamide
| Molecular Formula | C16H20N4O3S |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 3.4022 |
| Topological Polar Surface Area | 100.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.1256 |
| Heavy Atoms | 24 |
| Complexity | 737.9978 |
Chemical Identifiers
| CAS Number | 713098-28-3 |
|---|---|
| SMILES | C1CCCC(CC1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-] |
Product Overview
N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide (CAS 713098-28-3), with molecular formula C16H20N4O3S and molecular weight 348.13 g/mol. IUPAC: N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide
Property Insights of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide
The XLogP value of 3.4022 indicates that N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide. Following Lipinski's Rule of Five, N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide has 2 hydrogen bond donor(s) and 5 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-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide?
The CAS number of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide is 713098-28-3.
What is the molecular formula of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide?
The molecular formula of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide is C16H20N4O3S.
What is the molecular weight of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide?
The molecular weight of N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide is 348.13 g/mol.
Where can I buy N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide?
You can request a quote for N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-cycloheptyl-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.