![4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide structure](/static/products/3334/333424-22-9.webp)
4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide
TL;DR: 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide (CAS 333424-22-9) is a chemical compound with molecular formula C16H15ClN2O3S and molecular weight 350.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide
Also Known As: BAS 02854432, 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide, N-(4-chlorobenzoyl)-N'-(3,4-dimethoxyphenyl)thiourea, 1-(4-Chloro-benzoyl)-3-(3,4-dimethoxy-phenyl)-thiourea, N-{[(3,4-dimethoxyphenyl)amino]thioxomethyl}(4-chlorophenyl)carboxamide
| Molecular Formula | C16H15ClN2O3S |
|---|---|
| Molecular Weight | 350.05 g/mol |
| LogP | 3.484 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.0492 |
| Heavy Atoms | 23 |
| Complexity | 719.7653 |
Chemical Identifiers
| CAS Number | 333424-22-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl)OC |
Product Overview
4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide (CAS 333424-22-9), with molecular formula C16H15ClN2O3S and molecular weight 350.05 g/mol. IUPAC: 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide
Property Insights of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide
The XLogP value of 3.484 indicates that 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 4 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 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide?
The CAS number of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide is 333424-22-9.
What is the molecular formula of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide?
The molecular formula of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide is C16H15ClN2O3S.
What is the molecular weight of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide?
The molecular weight of 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide is 350.05 g/mol.
Where can I buy 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide?
You can request a quote for 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(3,4-dimethoxyphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.