N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide
TL;DR: N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide (CAS 426232-36-2) is a chemical compound with molecular formula C20H22Cl2N2O4S and molecular weight 456.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide
Also Known As: N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide, 1-(3,5-DICHLOROPHENYL)-3-(3,4,5-TRIETHOXYBENZOYL)THIOUREA, N-[(3,5-dichlorophenyl)thiocarbamoyl]-3,4,5-triethoxy-benzamide, N-{[(3,5-dichlorophenyl)amino]carbonothioyl}-3,4,5-triethoxybenzamide
| Molecular Formula | C20H22Cl2N2O4S |
|---|---|
| Molecular Weight | 456.07 g/mol |
| LogP | 5.3163 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.06772 |
| Heavy Atoms | 29 |
| Complexity | 845.5252 |
Chemical Identifiers
| CAS Number | 426232-36-2 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=CC(=C2)Cl)Cl |
Product Overview
N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide (CAS 426232-36-2), with molecular formula C20H22Cl2N2O4S and molecular weight 456.07 g/mol. IUPAC: N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide.
Chemical Property Profile of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide
Property Insights of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide
The XLogP value of 5.3163 indicates that N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide 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 N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide. Following Lipinski's Rule of Five, N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
The CAS number of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide is 426232-36-2.
What is the molecular formula of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
The molecular formula of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide is C20H22Cl2N2O4S.
What is the molecular weight of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
The molecular weight of N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide is 456.07 g/mol.
Where can I buy N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
You can request a quote for N-[(3,5-dichlorophenyl)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-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,5-dichlorophenyl)carbamothioyl]-3,4,5-triethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.