C16H13Cl3N2O2
TL;DR: C16H13Cl3N2O2 (CAS 496797-90-1) is a chemical compound with molecular formula C16H13Cl3N2O2 and molecular weight 370.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 3-chloro-4-methylbenzoate
Also Known As: N'-[(3-chloro-4-methylbenzoyl)oxy]-2-(2,4-dichlorophenyl)ethanimidamide, (1Z)-N'-{[(3-chloro-4-methylphenyl)carbonyl]oxy}-2-(2,4-dichlorophenyl)ethanimidamide, (Z)-N'-((3-chloro-4-methylbenzoyl)oxy)-2-(2,4-dichlorophenyl)acetimidamide
| Molecular Formula | C16H13Cl3N2O2 |
|---|---|
| Molecular Weight | 370.00 g/mol |
| LogP | 4.62692 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.00427 |
| Heavy Atoms | 23 |
| Complexity | 775.91583 |
Chemical Identifiers
| CAS Number | 496797-90-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O/N=C(/CC2=C(C=C(C=C2)Cl)Cl)\N)Cl |
Product Overview
C16H13Cl3N2O2 (CAS 496797-90-1), with molecular formula C16H13Cl3N2O2 and molecular weight 370.00 g/mol. IUPAC: [(Z)-[1-amino-2-(2,4-dichlorophenyl)ethylidene]amino] 3-chloro-4-methylbenzoate.
Chemical Property Profile of C16H13Cl3N2O2
Property Insights of C16H13Cl3N2O2
The XLogP value of 4.62692 indicates that C16H13Cl3N2O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.68 Ų falls within the moderate polarity range, balancing permeability and solubility for C16H13Cl3N2O2. Following Lipinski's Rule of Five, C16H13Cl3N2O2 has 1 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 C16H13Cl3N2O2?
The CAS number of C16H13Cl3N2O2 is 496797-90-1.
What is the molecular formula of C16H13Cl3N2O2?
The molecular formula of C16H13Cl3N2O2 is C16H13Cl3N2O2.
What is the molecular weight of C16H13Cl3N2O2?
The molecular weight of C16H13Cl3N2O2 is 370.00 g/mol.
Where can I buy C16H13Cl3N2O2?
You can request a quote for C16H13Cl3N2O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16H13Cl3N2O2?
Yes, KEHONG BIO provides custom synthesis services for C16H13Cl3N2O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.