1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea
TL;DR: 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea (CAS 445014-29-9) is a chemical compound with molecular formula C19H14ClN3OS and molecular weight 367.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea
Also Known As: 1-(4-chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea, N-(4-chlorophenyl)-N'-(3-cyano-5-methyl-4-phenylthien-2-yl)urea, N-(4-CHLOROPHENYL)-N'-(3-CYANO-5-METHYL-4-PHENYL-2-THIENYL)UREA, N-(4-chlorophenyl)[(3-cyano-5-methyl-4-phenyl(2-thienyl))amino]carboxamide
| Molecular Formula | C19H14ClN3OS |
|---|---|
| Molecular Weight | 367.05 g/mol |
| LogP | 5.8926 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.0546 |
| Heavy Atoms | 25 |
| Complexity | 943.2957 |
Chemical Identifiers
| CAS Number | 445014-29-9 |
|---|---|
| SMILES | CC1=C(C(=C(S1)NC(=O)NC2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3 |
Product Overview
1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea (CAS 445014-29-9), with molecular formula C19H14ClN3OS and molecular weight 367.05 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea
Property Insights of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea
The XLogP value of 5.8926 indicates that 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea?
The CAS number of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea is 445014-29-9.
What is the molecular formula of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea?
The molecular formula of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea is C19H14ClN3OS.
What is the molecular weight of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea?
The molecular weight of 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea is 367.05 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea?
You can request a quote for 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.