N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide
TL;DR: N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide (CAS 67716-01-2) is a chemical compound with molecular formula C15H22N2O4S and molecular weight 326.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide
Also Known As: N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide, AN-329/41574027, Benzamide, N-[(diethylamino)thioxomethyl]-3,4,5-trimethoxy-, N,N-diethyl-N'-(3,4,5-trimethoxybenzoyl)thiourea, N-[(diethylamino)carbonothioyl]-3,4,5-trimethoxybenzamide
| Molecular Formula | C15H22N2O4S |
|---|---|
| Molecular Weight | 326.13 g/mol |
| LogP | 2.0689 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.13004 |
| Heavy Atoms | 22 |
| Complexity | 519.3391 |
Chemical Identifiers
| CAS Number | 67716-01-2 |
|---|---|
| SMILES | CCN(CC)C(=S)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC |
Product Overview
N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide (CAS 67716-01-2), with molecular formula C15H22N2O4S and molecular weight 326.13 g/mol. IUPAC: N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide.
Chemical Property Profile of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide
Property Insights of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide
The XLogP value of 2.0689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide. The TPSA of 60.03 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide. Following Lipinski's Rule of Five, N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide has 1 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-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide?
The CAS number of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide is 67716-01-2.
What is the molecular formula of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide?
The molecular formula of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide is C15H22N2O4S.
What is the molecular weight of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide?
The molecular weight of N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide is 326.13 g/mol.
Where can I buy N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide?
You can request a quote for N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(diethylcarbamothioyl)-3,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.