N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea
TL;DR: N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea (CAS 333738-32-2) is a chemical compound with molecular formula C17H17BrN2O4S and molecular weight 424.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxybenzamide
Also Known As: BAS 02819555, N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea, 3-bromo-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxybenzamide, 1-(3-Bromo-4-methoxy-benzoyl)-3-(3,4-dimethoxy-phenyl)-thiourea, N-{[(3,4-dimethoxyphenyl)amino]thioxomethyl}(3-bromo-4-methoxyphenyl)carboxami de
| Molecular Formula | C17H17BrN2O4S |
|---|---|
| Molecular Weight | 424.01 g/mol |
| LogP | 3.6017 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.00925 |
| Heavy Atoms | 25 |
| Complexity | 798.21246 |
Chemical Identifiers
| CAS Number | 333738-32-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)OC |
Product Overview
N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea (CAS 333738-32-2), with molecular formula C17H17BrN2O4S and molecular weight 424.01 g/mol. IUPAC: 3-bromo-N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea
Property Insights of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea
The XLogP value of 3.6017 indicates that N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea has 2 hydrogen bond donor(s) and 5 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-dimethoxyphenyl)thiourea?
The CAS number of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea is 333738-32-2.
What is the molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea?
The molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea is C17H17BrN2O4S.
What is the molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea?
The molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea is 424.01 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea?
You can request a quote for N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.