A3211/0136199
TL;DR: A3211/0136199 (CAS 522649-99-6) is a chemical compound with molecular formula C25H21ClFN3O2S and molecular weight 481.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide
Also Known As: A3211/0136199, (2Z)-N-(2-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide, (Z)-N-(2-chlorophenyl)-3-(4-fluorophenethyl)-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide, N-(2-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide
| Molecular Formula | C25H21ClFN3O2S |
|---|---|
| Molecular Weight | 481.10 g/mol |
| LogP | 5.6821 |
| Topological Polar Surface Area | 61.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 481.1027 |
| Heavy Atoms | 33 |
| Complexity | 1171.7843 |
Chemical Identifiers
| CAS Number | 522649-99-6 |
|---|---|
| SMILES | C1C(SC(=NC2=CC=CC=C2)N(C1=O)CCC3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4Cl |
Product Overview
A3211/0136199 (CAS 522649-99-6), with molecular formula C25H21ClFN3O2S and molecular weight 481.10 g/mol. IUPAC: N-(2-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of A3211/0136199
Property Insights of A3211/0136199
The XLogP value of 5.6821 indicates that A3211/0136199 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.77 Ų falls within the moderate polarity range, balancing permeability and solubility for A3211/0136199. Following Lipinski's Rule of Five, A3211/0136199 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3211/0136199?
The CAS number of A3211/0136199 is 522649-99-6.
What is the molecular formula of A3211/0136199?
The molecular formula of A3211/0136199 is C25H21ClFN3O2S.
What is the molecular weight of A3211/0136199?
The molecular weight of A3211/0136199 is 481.10 g/mol.
Where can I buy A3211/0136199?
You can request a quote for A3211/0136199 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3211/0136199?
Yes, KEHONG BIO provides custom synthesis services for A3211/0136199 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.