BAS 02226201
TL;DR: BAS 02226201 (CAS 405902-44-5) is a chemical compound with molecular formula C27H26FN3O4S and molecular weight 507.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide
Also Known As: BAS 02226201, (2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide, (Z)-3-(3,4-dimethoxyphenethyl)-N-(4-fluorophenyl)-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide, 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide
| Molecular Formula | C27H26FN3O4S |
|---|---|
| Molecular Weight | 507.16 g/mol |
| LogP | 5.0459 |
| Topological Polar Surface Area | 80.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 507.1628 |
| Heavy Atoms | 36 |
| Complexity | 1251.6334 |
Chemical Identifiers
| CAS Number | 405902-44-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F)OC |
Product Overview
BAS 02226201 (CAS 405902-44-5), with molecular formula C27H26FN3O4S and molecular weight 507.16 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of BAS 02226201
Property Insights of BAS 02226201
The XLogP value of 5.0459 indicates that BAS 02226201 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.23 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02226201. Following Lipinski's Rule of Five, BAS 02226201 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02226201?
The CAS number of BAS 02226201 is 405902-44-5.
What is the molecular formula of BAS 02226201?
The molecular formula of BAS 02226201 is C27H26FN3O4S.
What is the molecular weight of BAS 02226201?
The molecular weight of BAS 02226201 is 507.16 g/mol.
Where can I buy BAS 02226201?
You can request a quote for BAS 02226201 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02226201?
Yes, KEHONG BIO provides custom synthesis services for BAS 02226201 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.