1-(4-脒基苯基)-3-(4-氯苯基)脲
TL;DR: 1-(4-脒基苯基)-3-(4-氯苯基)脲 (CAS 162021-00-3) is a chemical compound with molecular formula C14H13ClN4O and molecular weight 288.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-脒基苯基)-3-(4-氯苯基)脲
1-(4-carbamimidoylphenyl)-3-(4-chlorophenyl)urea
Also Known As: ACPU, urea, 1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA, 1-(4-carbamimidoylphenyl)-3-(4-chlorophenyl)urea, 4-[3-(4-Chlorophenyl)ureido]benzamidine, 3-(4-carbamimidoylphenyl)-1-(4-chlorophenyl)urea
| Molecular Formula | C14H13ClN4O |
|---|---|
| Molecular Weight | 288.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 91.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.0778 |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 162021-00-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=N)N)NC(=O)NC2=CC=C(C=C2)Cl |
| InChIKey | HQWKMDKTTCPCMQ-UHFFFAOYSA-N |
Product Overview
1-(4-脒基苯基)-3-(4-氯苯基)脲 (CAS 162021-00-3), with molecular formula C14H13ClN4O and molecular weight 288.08 g/mol. IUPAC: 1-(4-carbamimidoylphenyl)-3-(4-chlorophenyl)urea.
Chemical Property Profile of 1-(4-脒基苯基)-3-(4-氯苯基)脲
Property Insights of 1-(4-脒基苯基)-3-(4-氯苯基)脲
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-脒基苯基)-3-(4-氯苯基)脲. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-脒基苯基)-3-(4-氯苯基)脲. Following Lipinski's Rule of Five, 1-(4-脒基苯基)-3-(4-氯苯基)脲 has 4 hydrogen bond donor(s) and 2 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 1-(4-脒基苯基)-3-(4-氯苯基)脲?
The CAS number of 1-(4-脒基苯基)-3-(4-氯苯基)脲 is 162021-00-3.
What is the molecular formula of 1-(4-脒基苯基)-3-(4-氯苯基)脲?
The molecular formula of 1-(4-脒基苯基)-3-(4-氯苯基)脲 is C14H13ClN4O.
What is the molecular weight of 1-(4-脒基苯基)-3-(4-氯苯基)脲?
The molecular weight of 1-(4-脒基苯基)-3-(4-氯苯基)脲 is 288.08 g/mol.
Where can I buy 1-(4-脒基苯基)-3-(4-氯苯基)脲?
You can request a quote for 1-(4-脒基苯基)-3-(4-氯苯基)脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-脒基苯基)-3-(4-氯苯基)脲?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-脒基苯基)-3-(4-氯苯基)脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.