(1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate
TL;DR: (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate (CAS 343589-67-3) is a chemical compound with molecular formula C13H10ClNO2S and molecular weight 279.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-thiophen-2-ylethylideneamino) 2-chlorobenzoate
Also Known As: 1-(2-thienyl)ethanone O-(2-chlorobenzoyl)oxime, (1-thiophen-2-ylethylideneamino) 2-chlorobenzoate
| Molecular Formula | C13H10ClNO2S |
|---|---|
| Molecular Weight | 279.01 g/mol |
| LogP | 3.9825 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.0121 |
| Heavy Atoms | 18 |
| Complexity | 578.437 |
Chemical Identifiers
| CAS Number | 343589-67-3 |
|---|---|
| SMILES | CC(=NOC(=O)C1=CC=CC=C1Cl)C2=CC=CS2 |
Product Overview
(1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate (CAS 343589-67-3), with molecular formula C13H10ClNO2S and molecular weight 279.01 g/mol. IUPAC: (1-thiophen-2-ylethylideneamino) 2-chlorobenzoate.
Chemical Property Profile of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate
Property Insights of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate
The XLogP value of 3.9825 indicates that (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate has 0 hydrogen bond donor(s) and 4 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 (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate?
The CAS number of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate is 343589-67-3.
What is the molecular formula of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate?
The molecular formula of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate is C13H10ClNO2S.
What is the molecular weight of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate?
The molecular weight of (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate is 279.01 g/mol.
Where can I buy (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate?
You can request a quote for (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (1-Thiophen-2-ylethylideneamino) 2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.