BAS 02281122
TL;DR: BAS 02281122 (CAS 470707-91-6) is a chemical compound with molecular formula C21H23N3O3S and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethoxyphenyl)imino-3-ethyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
Also Known As: BAS 02281122, (2Z)-2-[(4-ethoxyphenyl)imino]-3-ethyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide, (Z)-2-((4-ethoxyphenyl)imino)-3-ethyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide, 2-(4-ethoxyphenyl)imino-3-ethyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
| Molecular Formula | C21H23N3O3S |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 4.0655 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.14603 |
| Heavy Atoms | 28 |
| Complexity | 852.95935 |
Chemical Identifiers
| CAS Number | 470707-91-6 |
|---|---|
| SMILES | CCN1C(=O)CC(SC1=NC2=CC=C(C=C2)OCC)C(=O)NC3=CC=CC=C3 |
Product Overview
BAS 02281122 (CAS 470707-91-6), with molecular formula C21H23N3O3S and molecular weight 397.15 g/mol. IUPAC: 2-(4-ethoxyphenyl)imino-3-ethyl-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of BAS 02281122
Property Insights of BAS 02281122
The XLogP value of 4.0655 indicates that BAS 02281122 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02281122. Following Lipinski's Rule of Five, BAS 02281122 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 BAS 02281122?
The CAS number of BAS 02281122 is 470707-91-6.
What is the molecular formula of BAS 02281122?
The molecular formula of BAS 02281122 is C21H23N3O3S.
What is the molecular weight of BAS 02281122?
The molecular weight of BAS 02281122 is 397.15 g/mol.
Where can I buy BAS 02281122?
You can request a quote for BAS 02281122 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02281122?
Yes, KEHONG BIO provides custom synthesis services for BAS 02281122 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.