N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea
TL;DR: N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea (CAS 335214-73-8) is a chemical compound with molecular formula C17H17BrN2O2S and molecular weight 392.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(3,4-dimethylphenyl)carbamothioyl]-4-methoxybenzamide
Also Known As: BAS 02819545, 3-bromo-N-[(3,4-dimethylphenyl)carbamothioyl]-4-methoxybenzamide, N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea, 1-(3-Bromo-4-methoxy-benzoyl)-3-(3,4-dimethyl-phenyl)-thiourea, N-{[(3,4-dimethylphenyl)amino]thioxomethyl}(3-bromo-4-methoxyphenyl)carboxamid e
| Molecular Formula | C17H17BrN2O2S |
|---|---|
| Molecular Weight | 392.02 g/mol |
| LogP | 4.20134 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.0194 |
| Heavy Atoms | 23 |
| Complexity | 762.2537 |
Chemical Identifiers
| CAS Number | 335214-73-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)C |
Product Overview
N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea (CAS 335214-73-8), with molecular formula C17H17BrN2O2S and molecular weight 392.02 g/mol. IUPAC: 3-bromo-N-[(3,4-dimethylphenyl)carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea
Property Insights of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea
The XLogP value of 4.20134 indicates that N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)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'-(3,4-dimethylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)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'-(3,4-dimethylphenyl)thiourea?
The CAS number of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea is 335214-73-8.
What is the molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea?
The molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea is C17H17BrN2O2S.
What is the molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea?
The molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea is 392.02 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea?
You can request a quote for N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)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'-(3,4-dimethylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.