![1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea structure](/static/products/7019/701948-62-1.webp)
1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea
TL;DR: 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea (CAS 701948-62-1) is a chemical compound with molecular formula C17H18ClN3O3S and molecular weight 379.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea
Also Known As: 1-[(4-chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea, 3-(3,4-dihydroxyphenyl)-N-[({[(4-chlorophenyl)methyl]amino}thioxomethyl)amino] propanamide, N-(4-chlorobenzyl)-2-[3-(3,4-dihydroxyphenyl)propanoyl]hydrazinecarbothioamide
| Molecular Formula | C17H18ClN3O3S |
|---|---|
| Molecular Weight | 379.08 g/mol |
| LogP | 2.3793 |
| Topological Polar Surface Area | 93.62 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.07574 |
| Heavy Atoms | 25 |
| Complexity | 753.30334 |
Chemical Identifiers
| CAS Number | 701948-62-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=S)NNC(=O)CCC2=CC(=C(C=C2)O)O)Cl |
Product Overview
1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea (CAS 701948-62-1), with molecular formula C17H18ClN3O3S and molecular weight 379.08 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea.
Chemical Property Profile of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea
Property Insights of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea
The XLogP value of 2.3793 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea. The TPSA of 93.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea. Following Lipinski's Rule of Five, 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea has 5 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 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea?
The CAS number of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea is 701948-62-1.
What is the molecular formula of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea?
The molecular formula of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea is C17H18ClN3O3S.
What is the molecular weight of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea?
The molecular weight of 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea is 379.08 g/mol.
Where can I buy 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea?
You can request a quote for 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]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)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Chlorophenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)propanoylamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.