BAS 02226152
TL;DR: BAS 02226152 (CAS 492452-17-2) is a chemical compound with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-ethyl-2-ethylimino-4-oxo-1,3-thiazinane-6-carbonyl)amino]benzoic acid
Also Known As: BAS 02226152, BRD-A50385124-001-01-0, 4-({[(2Z)-3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinan-6-yl]carbonyl}amino)benzoic acid, (Z)-4-(3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carboxamido)benzoic acid, 4-({[3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinan-6-yl]carbonyl}amino)benzoic acid
| Molecular Formula | C16H19N3O4S |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | 2.0532 |
| Topological Polar Surface Area | 99.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.10962 |
| Heavy Atoms | 24 |
| Complexity | 672.405 |
Chemical Identifiers
| CAS Number | 492452-17-2 |
|---|---|
| SMILES | CCN=C1N(C(=O)CC(S1)C(=O)NC2=CC=C(C=C2)C(=O)O)CC |
Product Overview
BAS 02226152 (CAS 492452-17-2), with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol. IUPAC: 4-[(3-ethyl-2-ethylimino-4-oxo-1,3-thiazinane-6-carbonyl)amino]benzoic acid.
Chemical Property Profile of BAS 02226152
Property Insights of BAS 02226152
The XLogP value of 2.0532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02226152. The TPSA of 99.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02226152. Following Lipinski's Rule of Five, BAS 02226152 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 02226152?
The CAS number of BAS 02226152 is 492452-17-2.
What is the molecular formula of BAS 02226152?
The molecular formula of BAS 02226152 is C16H19N3O4S.
What is the molecular weight of BAS 02226152?
The molecular weight of BAS 02226152 is 349.11 g/mol.
Where can I buy BAS 02226152?
You can request a quote for BAS 02226152 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02226152?
Yes, KEHONG BIO provides custom synthesis services for BAS 02226152 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.