N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide
TL;DR: N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide (CAS 303062-65-9) is a chemical compound with molecular formula C18H16Cl3N3O2S and molecular weight 443.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[(4-acetylphenyl)carbamothioylamino]-2,2,2-trichloroethyl]benzamide
Also Known As: BIM-0046545.P001, N-(1-(((4-ACETYLANILINO)CARBOTHIOYL)AMINO)-2,2,2-TRICHLOROETHYL)BENZAMIDE, N-[1-({[(4-acetylphenyl)amino]carbonothioyl}amino)-2,2,2-trichloroethyl]benzamide, N-[1-[(4-acetylphenyl)carbamothioylamino]-2,2,2-trichloroethyl]benzamide, 661-067-5
| Molecular Formula | C18H16Cl3N3O2S |
|---|---|
| Molecular Weight | 443.00 g/mol |
| LogP | 4.3019 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.00287 |
| Heavy Atoms | 27 |
| Complexity | 823.99554 |
Chemical Identifiers
| CAS Number | 303062-65-9 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=CC=C2 |
Product Overview
N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide (CAS 303062-65-9), with molecular formula C18H16Cl3N3O2S and molecular weight 443.00 g/mol. IUPAC: N-[1-[(4-acetylphenyl)carbamothioylamino]-2,2,2-trichloroethyl]benzamide.
Chemical Property Profile of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide
Property Insights of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide
The XLogP value of 4.3019 indicates that N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide. Following Lipinski's Rule of Five, N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide has 3 hydrogen bond donor(s) and 3 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-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide?
The CAS number of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide is 303062-65-9.
What is the molecular formula of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide?
The molecular formula of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide is C18H16Cl3N3O2S.
What is the molecular weight of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide?
The molecular weight of N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide is 443.00 g/mol.
Where can I buy N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide?
You can request a quote for N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-(((4-Acetylanilino)carbothioyl)amino)-2,2,2-trichloroethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.