A3240/0137610
TL;DR: A3240/0137610 (CAS 587849-82-9) is a chemical compound with molecular formula C26H21ClF3N3O2S and molecular weight 531.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-N-(3-chloro-4-methylphenyl)-4-oxo-2-[4-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide
Also Known As: A3240/0137610, (2E)-3-BENZYL-N-(3-CHLORO-4-METHYLPHENYL)-4-OXO-2-{[4-(TRIFLUOROMETHYL)PHENYL]IMINO}-13-THIAZINANE-6-CARBOXAMIDE, (2Z)-3-benzyl-N-(3-chloro-4-methylphenyl)-4-oxo-2-{[4-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxamide, (Z)-3-benzyl-N-(3-chloro-4-methylphenyl)-4-oxo-2-((4-(trifluoromethyl)phenyl)imino)-1,3-thiazinane-6-carboxamide, 3-benzyl-N-(3-chloro-4-methylphenyl)-4-oxo-2-[4-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide
| Molecular Formula | C26H21ClF3N3O2S |
|---|---|
| Molecular Weight | 531.10 g/mol |
| LogP | 6.82772 |
| Topological Polar Surface Area | 61.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 531.0995 |
| Heavy Atoms | 36 |
| Complexity | 1298.0366 |
Chemical Identifiers
| CAS Number | 587849-82-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)C(F)(F)F)S2)CC4=CC=CC=C4)Cl |
Product Overview
A3240/0137610 (CAS 587849-82-9), with molecular formula C26H21ClF3N3O2S and molecular weight 531.10 g/mol. IUPAC: 3-benzyl-N-(3-chloro-4-methylphenyl)-4-oxo-2-[4-(trifluoromethyl)phenyl]imino-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of A3240/0137610
Property Insights of A3240/0137610
The XLogP value of 6.82772 indicates that A3240/0137610 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 A3240/0137610. Following Lipinski's Rule of Five, A3240/0137610 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 A3240/0137610?
The CAS number of A3240/0137610 is 587849-82-9.
What is the molecular formula of A3240/0137610?
The molecular formula of A3240/0137610 is C26H21ClF3N3O2S.
What is the molecular weight of A3240/0137610?
The molecular weight of A3240/0137610 is 531.10 g/mol.
Where can I buy A3240/0137610?
You can request a quote for A3240/0137610 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3240/0137610?
Yes, KEHONG BIO provides custom synthesis services for A3240/0137610 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.