A3211/0136186
TL;DR: A3211/0136186 (CAS 522649-84-9) is a chemical compound with molecular formula C28H28FN3O4S and molecular weight 521.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-2-(2-fluorophenyl)imino-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide
Also Known As: A3211/0136186, (2Z)-N-(4-ethoxyphenyl)-2-[(2-fluorophenyl)imino]-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide, (Z)-N-(4-ethoxyphenyl)-2-((2-fluorophenyl)imino)-3-(4-methoxyphenethyl)-4-oxo-1,3-thiazinane-6-carboxamide, (2Z)-N-(4-ETHOXYPHENYL)-2-[(2-FLUOROPHENYL)IMINO]-3-[2-(4-METHOXYPHENYL)ETHYL]-4-OXO-13-THIAZINANE-6-CARBOXAMIDE, N-(4-ethoxyphenyl)-2-(2-fluorophenyl)imino-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide
| Molecular Formula | C28H28FN3O4S |
|---|---|
| Molecular Weight | 521.18 g/mol |
| LogP | 5.436 |
| Topological Polar Surface Area | 80.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 521.17847 |
| Heavy Atoms | 37 |
| Complexity | 1265.1787 |
Chemical Identifiers
| CAS Number | 522649-84-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3F)S2)CCC4=CC=C(C=C4)OC |
Product Overview
A3211/0136186 (CAS 522649-84-9), with molecular formula C28H28FN3O4S and molecular weight 521.18 g/mol. IUPAC: N-(4-ethoxyphenyl)-2-(2-fluorophenyl)imino-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of A3211/0136186
Property Insights of A3211/0136186
The XLogP value of 5.436 indicates that A3211/0136186 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 A3211/0136186. Following Lipinski's Rule of Five, A3211/0136186 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 A3211/0136186?
The CAS number of A3211/0136186 is 522649-84-9.
What is the molecular formula of A3211/0136186?
The molecular formula of A3211/0136186 is C28H28FN3O4S.
What is the molecular weight of A3211/0136186?
The molecular weight of A3211/0136186 is 521.18 g/mol.
Where can I buy A3211/0136186?
You can request a quote for A3211/0136186 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3211/0136186?
Yes, KEHONG BIO provides custom synthesis services for A3211/0136186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.