N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea
TL;DR: N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea (CAS 640242-35-9) is a chemical compound with molecular formula C14H10Cl2N2O2S and molecular weight 339.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]benzamide
Also Known As: N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea, N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]benzamide, AP-970/41860788, N-[(3,5-dichloro-4-hydroxy-phenyl)thiocarbamoyl]benzamide, N-{[(3,5-dichloro-4-hydroxyphenyl)amino]thioxomethyl}benzamide
| Molecular Formula | C14H10Cl2N2O2S |
|---|---|
| Molecular Weight | 339.98 g/mol |
| LogP | 3.8258 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.984 |
| Heavy Atoms | 21 |
| Complexity | 669.6234 |
Chemical Identifiers
| CAS Number | 640242-35-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Cl)O)Cl |
Product Overview
N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea (CAS 640242-35-9), with molecular formula C14H10Cl2N2O2S and molecular weight 339.98 g/mol. IUPAC: N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]benzamide.
Chemical Property Profile of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea
Property Insights of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea
The XLogP value of 3.8258 indicates that N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea. Following Lipinski's Rule of Five, N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea has 3 hydrogen bond donor(s) and 3 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 N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea?
The CAS number of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea is 640242-35-9.
What is the molecular formula of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea?
The molecular formula of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea is C14H10Cl2N2O2S.
What is the molecular weight of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea?
The molecular weight of N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea is 339.98 g/mol.
Where can I buy N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea?
You can request a quote for N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-benzoyl-N'-(3,5-dichloro-4-hydroxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.