Not Available
TL;DR: Not Available (CAS 847231-83-8) is a chemical compound with molecular formula C23H18ClN3O3S and molecular weight 451.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylbenzimidazole-1-carboxylate
Also Known As: Not Available, Benzyl 2-[(4-chlorophenylcarbamoyl)methylthio]-1H-benzo[d]imidazole-1-carboxylate, AI-067/31573007, benzyl 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylbenzimidazole-1-carboxylate, Benzyl 2-((2-((4-chlorophenyl)amino)-2-oxoethyl)thio)-1H-benzo[d]imidazole-1-carboxylate
| Molecular Formula | C23H18ClN3O3S |
|---|---|
| Molecular Weight | 451.08 g/mol |
| LogP | 5.6054 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.07574 |
| Heavy Atoms | 31 |
| Complexity | 1209.964 |
Chemical Identifiers
| CAS Number | 847231-83-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)N2C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)Cl |
Product Overview
Not Available (CAS 847231-83-8), with molecular formula C23H18ClN3O3S and molecular weight 451.08 g/mol. IUPAC: benzyl 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylbenzimidazole-1-carboxylate.
Chemical Property Profile of Not Available
Property Insights of Not Available
The XLogP value of 5.6054 indicates that Not Available is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Not Available. Following Lipinski's Rule of Five, Not Available has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Not Available?
The CAS number of Not Available is 847231-83-8.
What is the molecular formula of Not Available?
The molecular formula of Not Available is C23H18ClN3O3S.
What is the molecular weight of Not Available?
The molecular weight of Not Available is 451.08 g/mol.
Where can I buy Not Available?
You can request a quote for Not Available directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Not Available?
Yes, KEHONG BIO provides custom synthesis services for Not Available and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.