1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea
TL;DR: 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea (CAS 667442-95-7) is a chemical compound with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(3-phenylpropanoylamino)thiourea
Also Known As: 1-(4-chlorophenyl)-3-(3-phenylpropanoylamino)thiourea, N-(4-chlorophenyl)-2-(3-phenylpropanoyl)hydrazinecarbothioamide, N-({[(4-chlorophenyl)amino]thioxomethyl}amino)-3-phenylpropanamide
| Molecular Formula | C16H16ClN3OS |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 3.2904 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.07025 |
| Heavy Atoms | 22 |
| Complexity | 631.599 |
Chemical Identifiers
| CAS Number | 667442-95-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl |
Product Overview
1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea (CAS 667442-95-7), with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(3-phenylpropanoylamino)thiourea.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea
Property Insights of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea
The XLogP value of 3.2904 indicates that 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea has 3 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-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea?
The CAS number of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea is 667442-95-7.
What is the molecular formula of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea?
The molecular formula of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea is C16H16ClN3OS.
What is the molecular weight of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea?
The molecular weight of 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea is 333.07 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea?
You can request a quote for 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea 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-phenylpropanoylamino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-(3-phenylpropanoylamino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.