![3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide structure](/static/products/7244/72449-80-0.webp)
3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide
TL;DR: 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide (CAS 72449-80-0) is a chemical compound with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide
Also Known As: BAS 02819288, 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide, 1-m-Tolyl-3-(3,4,5-trimethoxy-benzoyl)-thiourea, 1-(3-methylphenyl)-3-(3,4,5-trimethoxybenzoyl)thiourea, N-{[(3-methylphenyl)amino]thioxomethyl}(3,4,5-trimethoxyphenyl)carboxamide
| Molecular Formula | C18H20N2O4S |
|---|---|
| Molecular Weight | 360.11 g/mol |
| LogP | 3.14762 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.11438 |
| Heavy Atoms | 25 |
| Complexity | 767.3907 |
Chemical Identifiers
| CAS Number | 72449-80-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide (CAS 72449-80-0), with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol. IUPAC: 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide
Property Insights of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide
The XLogP value of 3.14762 indicates that 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide 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 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide 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 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide?
The CAS number of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide is 72449-80-0.
What is the molecular formula of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide?
The molecular formula of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide is C18H20N2O4S.
What is the molecular weight of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide?
The molecular weight of 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide is 360.11 g/mol.
Where can I buy 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide?
You can request a quote for 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-trimethoxy-N-[(3-methylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.