N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea
TL;DR: N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea (CAS 335214-72-7) is a chemical compound with molecular formula C16H15BrN2O2S and molecular weight 378.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-methoxy-N-[(4-methylphenyl)carbamothioyl]benzamide
Also Known As: BAS 02819543, N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea, 1-(3-Bromo-4-methoxy-benzoyl)-3-p-tolyl-thiourea, 3-bromo-4-methoxy-N-(p-tolylcarbamothioyl)benzamide, 3-bromo-4-methoxy-N-[(4-methylphenyl)carbamothioyl]benzamide
| Molecular Formula | C16H15BrN2O2S |
|---|---|
| Molecular Weight | 378.00 g/mol |
| LogP | 3.89292 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.00375 |
| Heavy Atoms | 22 |
| Complexity | 701.79205 |
Chemical Identifiers
| CAS Number | 335214-72-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br |
Product Overview
N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea (CAS 335214-72-7), with molecular formula C16H15BrN2O2S and molecular weight 378.00 g/mol. IUPAC: 3-bromo-4-methoxy-N-[(4-methylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea
Property Insights of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea
The XLogP value of 3.89292 indicates that N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea has 2 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-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea?
The CAS number of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea is 335214-72-7.
What is the molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea?
The molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea is C16H15BrN2O2S.
What is the molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea?
The molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea is 378.00 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea?
You can request a quote for N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzoyl)-N'-(4-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.