RefChem:322160
TL;DR: RefChem:322160 (CAS 77051-92-4) is a chemical compound with molecular formula C20H21ClN4O3S and molecular weight 432.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(4-chlorophenyl)carbamothioylamino]cyclopentyl]-N-methyl-4-nitrobenzamide
Also Known As: Benzamide,N-(2-((( -N-methyl-4-nitro-, N-(2-((((4-Chlorophenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitrobenzamide, Benzamide, N-(2-((((4-chlorophenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitro-, N-[2-[(4-chlorophenyl)carbamothioylamino]cyclopentyl]-N-meth, N-[2-[(4-chlorophenyl)carbamothioylamino]cyclopentyl]-N-methyl-4-nitrobenzamide
| Molecular Formula | C20H21ClN4O3S |
|---|---|
| Molecular Weight | 432.10 g/mol |
| LogP | 4.2279 |
| Topological Polar Surface Area | 87.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.1023 |
| Heavy Atoms | 29 |
| Complexity | 904.94727 |
Chemical Identifiers
| CAS Number | 77051-92-4 |
|---|---|
| SMILES | CN(C1CCCC1NC(=S)NC2=CC=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
RefChem:322160 (CAS 77051-92-4), with molecular formula C20H21ClN4O3S and molecular weight 432.10 g/mol. IUPAC: N-[2-[(4-chlorophenyl)carbamothioylamino]cyclopentyl]-N-methyl-4-nitrobenzamide.
Chemical Property Profile of RefChem:322160
Property Insights of RefChem:322160
The XLogP value of 4.2279 indicates that RefChem:322160 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.51 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322160. Following Lipinski's Rule of Five, RefChem:322160 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 RefChem:322160?
The CAS number of RefChem:322160 is 77051-92-4.
What is the molecular formula of RefChem:322160?
The molecular formula of RefChem:322160 is C20H21ClN4O3S.
What is the molecular weight of RefChem:322160?
The molecular weight of RefChem:322160 is 432.10 g/mol.
Where can I buy RefChem:322160?
You can request a quote for RefChem:322160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322160?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.