![N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide structure](/static/products/4454/445418-55-3.webp)
N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide
TL;DR: N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide (CAS 445418-55-3) is a chemical compound with molecular formula C22H27ClN2O6S and molecular weight 482.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide
Also Known As: AN-465/41164568, N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide, N-(4-chloro-2,5-dimethoxyphenyl)-N'-(3,4,5-triethoxybenzoyl)thiourea
| Molecular Formula | C22H27ClN2O6S |
|---|---|
| Molecular Weight | 482.13 g/mol |
| LogP | 4.6801 |
| Topological Polar Surface Area | 87.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 482.12784 |
| Heavy Atoms | 32 |
| Complexity | 942.6726 |
Chemical Identifiers
| CAS Number | 445418-55-3 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC |
Product Overview
N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide (CAS 445418-55-3), with molecular formula C22H27ClN2O6S and molecular weight 482.13 g/mol. IUPAC: N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide.
Chemical Property Profile of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide
Property Insights of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide
The XLogP value of 4.6801 indicates that N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.28 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide. Following Lipinski's Rule of Five, N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide has 2 hydrogen bond donor(s) and 7 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-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
The CAS number of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide is 445418-55-3.
What is the molecular formula of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
The molecular formula of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide is C22H27ClN2O6S.
What is the molecular weight of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
The molecular weight of N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide is 482.13 g/mol.
Where can I buy N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
You can request a quote for N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3,4,5-triethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.