1-Benzoyl-3-(3,5-dimethylphenyl)thiourea
TL;DR: 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea (CAS 117174-79-5) is a chemical compound with molecular formula C16H16N2OS and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dimethylphenyl)carbamothioyl]benzamide
Also Known As: 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea, N-[(3,5-dimethylphenyl)carbamothioyl]benzamide, N-((3,5-Dimethylphenyl)carbamothioyl)benzamide, N-(3,5-Dimethylphenyl)carbamothioylbenzamide, N-(3,5-dimethylphenylcarbamothioyl)benzamide
| Molecular Formula | C16H16N2OS |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.43024 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.09833 |
| Heavy Atoms | 20 |
| Complexity | 617.93005 |
Chemical Identifiers
| CAS Number | 117174-79-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=CC=C2)C |
Product Overview
1-Benzoyl-3-(3,5-dimethylphenyl)thiourea (CAS 117174-79-5), with molecular formula C16H16N2OS and molecular weight 284.10 g/mol. IUPAC: N-[(3,5-dimethylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea
Property Insights of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea
The XLogP value of 3.43024 indicates that 1-Benzoyl-3-(3,5-dimethylphenyl)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-(3,5-dimethylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzoyl-3-(3,5-dimethylphenyl)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-(3,5-dimethylphenyl)thiourea?
The CAS number of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea is 117174-79-5.
What is the molecular formula of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea?
The molecular formula of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea is C16H16N2OS.
What is the molecular weight of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea?
The molecular weight of 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea is 284.10 g/mol.
Where can I buy 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea?
You can request a quote for 1-Benzoyl-3-(3,5-dimethylphenyl)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-(3,5-dimethylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzoyl-3-(3,5-dimethylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.