A3414/0144814
TL;DR: A3414/0144814 (CAS 522650-21-1) is a chemical compound with molecular formula C25H20Cl2FN3O2S and molecular weight 515.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-2-(4-chlorophenyl)imino-3-[2-(4-fluorophenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide
Also Known As: A3414/0144814, (2Z)-N-(3-chlorophenyl)-2-[(4-chlorophenyl)imino]-3-[2-(4-fluorophenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide, (2Z)-N-(3-CHLOROPHENYL)-2-[(4-CHLOROPHENYL)IMINO]-3-[2-(4-FLUOROPHENYL)ETHYL]-4-OXO-13-THIAZINANE-6-CARBOXAMIDE, (Z)-N-(3-chlorophenyl)-2-((4-chlorophenyl)imino)-3-(4-fluorophenethyl)-4-oxo-1,3-thiazinane-6-carboxamide, N-(3-chlorophenyl)-2-(4-chlorophenyl)imino-3-[2-(4-fluorophenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide
| Molecular Formula | C25H20Cl2FN3O2S |
|---|---|
| Molecular Weight | 515.06 g/mol |
| LogP | 6.3355 |
| Topological Polar Surface Area | 61.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 515.0637 |
| Heavy Atoms | 34 |
| Complexity | 1219.5902 |
Chemical Identifiers
| CAS Number | 522650-21-1 |
|---|---|
| SMILES | C1C(SC(=NC2=CC=C(C=C2)Cl)N(C1=O)CCC3=CC=C(C=C3)F)C(=O)NC4=CC(=CC=C4)Cl |
Product Overview
A3414/0144814 (CAS 522650-21-1), with molecular formula C25H20Cl2FN3O2S and molecular weight 515.06 g/mol. IUPAC: N-(3-chlorophenyl)-2-(4-chlorophenyl)imino-3-[2-(4-fluorophenyl)ethyl]-4-oxo-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of A3414/0144814
Property Insights of A3414/0144814
The XLogP value of 6.3355 indicates that A3414/0144814 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 A3414/0144814. Following Lipinski's Rule of Five, A3414/0144814 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 A3414/0144814?
The CAS number of A3414/0144814 is 522650-21-1.
What is the molecular formula of A3414/0144814?
The molecular formula of A3414/0144814 is C25H20Cl2FN3O2S.
What is the molecular weight of A3414/0144814?
The molecular weight of A3414/0144814 is 515.06 g/mol.
Where can I buy A3414/0144814?
You can request a quote for A3414/0144814 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3414/0144814?
Yes, KEHONG BIO provides custom synthesis services for A3414/0144814 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.