1-Benzoyl-3-(3-methylphenyl)thiourea
TL;DR: 1-Benzoyl-3-(3-methylphenyl)thiourea (CAS 4949-87-5) is a chemical compound with molecular formula C15H14N2OS and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methylphenyl)carbamothioyl]benzamide
Also Known As: 1-Benzoyl-3-(3-methylphenyl)thiourea, n-benzoyl-n'-(3-methylphenyl)thiourea, N-[(3-methylphenyl)carbamothioyl]benzamide, N-[(3-methylphenyl)thiocarbamoyl]benzamide, benzamide,n-[[(3-methylphenyl)amino]thioxomethyl]-
| Molecular Formula | C15H14N2OS |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 3.12182 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.08267 |
| Heavy Atoms | 19 |
| Complexity | 596.1044 |
Chemical Identifiers
| CAS Number | 4949-87-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
1-Benzoyl-3-(3-methylphenyl)thiourea (CAS 4949-87-5), with molecular formula C15H14N2OS and molecular weight 270.08 g/mol. IUPAC: N-[(3-methylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 1-Benzoyl-3-(3-methylphenyl)thiourea
Property Insights of 1-Benzoyl-3-(3-methylphenyl)thiourea
The XLogP value of 3.12182 indicates that 1-Benzoyl-3-(3-methylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-Benzoyl-3-(3-methylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzoyl-3-(3-methylphenyl)thiourea has 2 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-Benzoyl-3-(3-methylphenyl)thiourea?
The CAS number of 1-Benzoyl-3-(3-methylphenyl)thiourea is 4949-87-5.
What is the molecular formula of 1-Benzoyl-3-(3-methylphenyl)thiourea?
The molecular formula of 1-Benzoyl-3-(3-methylphenyl)thiourea is C15H14N2OS.
What is the molecular weight of 1-Benzoyl-3-(3-methylphenyl)thiourea?
The molecular weight of 1-Benzoyl-3-(3-methylphenyl)thiourea is 270.08 g/mol.
Where can I buy 1-Benzoyl-3-(3-methylphenyl)thiourea?
You can request a quote for 1-Benzoyl-3-(3-methylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzoyl-3-(3-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzoyl-3-(3-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.