EINECS 260-536-8
TL;DR: EINECS 260-536-8 (CAS 57059-34-4) is a chemical compound with molecular formula C16H11Cl2N3O3 and molecular weight 363.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydropyrido[3,2-e][1,4]diazepin-3-yl] acetate
Also Known As: 3-(ACETOXY)-7-CHLORO-5-(2-CHLOROPHENYL)-1,3-DIHYDRO-2H-PYRIDO[3,2-E]-1,4-DIAZEPIN-2-ONE, [7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydropyrido[3,2-e][1,4]diazepin-3-yl] acetate, 3-(Acetoxy)-7-chloro-5-(2-chlorophenyl)-1,3-dihydro-2H-pyrido(3,2-e)-1,4-diazepin-2-one, 7-chloro-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1h-pyrido[3,2-e][1,4]diazepin-3-yl acetate, 7-Chloro-5-(2-chlorophenyl)-2-hydroxy-3H-pyrido[3,2-e][1,4]diazepin-3-yl acetate
| Molecular Formula | C16H11Cl2N3O3 |
|---|---|
| Molecular Weight | 363.02 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.01776 |
| Heavy Atoms | 24 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 57059-34-4 |
|---|---|
| SMILES | CC(=O)OC1C(=O)NC2=C(C(=N1)C3=CC=CC=C3Cl)N=C(C=C2)Cl |
| InChIKey | UYCMAQWEBUMMAV-UHFFFAOYSA-N |
Product Overview
EINECS 260-536-8 (CAS 57059-34-4), with molecular formula C16H11Cl2N3O3 and molecular weight 363.02 g/mol. IUPAC: [7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydropyrido[3,2-e][1,4]diazepin-3-yl] acetate.
Chemical Property Profile of EINECS 260-536-8
Property Insights of EINECS 260-536-8
The XLogP value of 3.3 indicates that EINECS 260-536-8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 260-536-8. Following Lipinski's Rule of Five, EINECS 260-536-8 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 EINECS 260-536-8?
The CAS number of EINECS 260-536-8 is 57059-34-4.
What is the molecular formula of EINECS 260-536-8?
The molecular formula of EINECS 260-536-8 is C16H11Cl2N3O3.
What is the molecular weight of EINECS 260-536-8?
The molecular weight of EINECS 260-536-8 is 363.02 g/mol.
Where can I buy EINECS 260-536-8?
You can request a quote for EINECS 260-536-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 260-536-8?
Yes, KEHONG BIO provides custom synthesis services for EINECS 260-536-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.