BAS 02281140
TL;DR: BAS 02281140 (CAS 470453-02-2) is a chemical compound with molecular formula C20H18ClN3O4S and molecular weight 431.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-(4-chlorophenyl)imino-3-ethyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid
Also Known As: BAS 02281140, (Z)-4-(2-((4-chlorophenyl)imino)-3-ethyl-4-oxo-1,3-thiazinane-6-carboxamido)benzoic acid, 4-[[2-(4-chlorophenyl)imino-3-ethyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid, 4-[({(2Z)-2-[(4-chlorophenyl)imino]-3-ethyl-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
| Molecular Formula | C20H18ClN3O4S |
|---|---|
| Molecular Weight | 431.07 g/mol |
| LogP | 4.0184 |
| Topological Polar Surface Area | 99.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.07065 |
| Heavy Atoms | 29 |
| Complexity | 960.69653 |
Chemical Identifiers
| CAS Number | 470453-02-2 |
|---|---|
| SMILES | CCN1C(=O)CC(SC1=NC2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)O |
Product Overview
BAS 02281140 (CAS 470453-02-2), with molecular formula C20H18ClN3O4S and molecular weight 431.07 g/mol. IUPAC: 4-[[2-(4-chlorophenyl)imino-3-ethyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid.
Chemical Property Profile of BAS 02281140
Property Insights of BAS 02281140
The XLogP value of 4.0184 indicates that BAS 02281140 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02281140. Following Lipinski's Rule of Five, BAS 02281140 has 2 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 BAS 02281140?
The CAS number of BAS 02281140 is 470453-02-2.
What is the molecular formula of BAS 02281140?
The molecular formula of BAS 02281140 is C20H18ClN3O4S.
What is the molecular weight of BAS 02281140?
The molecular weight of BAS 02281140 is 431.07 g/mol.
Where can I buy BAS 02281140?
You can request a quote for BAS 02281140 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02281140?
Yes, KEHONG BIO provides custom synthesis services for BAS 02281140 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.