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N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide
TL;DR: N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide (CAS 333740-94-6) is a chemical compound with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide
Also Known As: BAS 02820788, N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide, N-(3,4-dimethoxyphenyl)-N'-(2-methylbenzoyl)thiourea, 1-(3,4-Dimethoxy-phenyl)-3-(2-methyl-benzoyl)-thiourea, N-{[(3,4-dimethoxyphenyl)amino]thioxomethyl}(2-methylphenyl)carboxamide
| Molecular Formula | C17H18N2O3S |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 3.13902 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.10382 |
| Heavy Atoms | 23 |
| Complexity | 731.52844 |
Chemical Identifiers
| CAS Number | 333740-94-6 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)OC)OC |
Product Overview
N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide (CAS 333740-94-6), with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide.
Chemical Property Profile of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide
Property Insights of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide
The XLogP value of 3.13902 indicates that N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide 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 N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide?
The CAS number of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide is 333740-94-6.
What is the molecular formula of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide?
The molecular formula of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide is C17H18N2O3S.
What is the molecular weight of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide?
The molecular weight of N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide is 330.10 g/mol.
Where can I buy N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide?
You can request a quote for N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.