AF-399/15128605
TL;DR: AF-399/15128605 (CAS 315694-11-2) is a chemical compound with molecular formula C25H19ClF3N3O2S2 and molecular weight 549.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: AF-399/15128605, F0863-0520, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, N-(4-chloro-3-(trifluoromethyl)phenyl)-2-((4-oxo-3-phenyl-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-({3-oxo-4-phenyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}sulfanyl)acetamide
| Molecular Formula | C25H19ClF3N3O2S2 |
|---|---|
| Molecular Weight | 549.06 g/mol |
| LogP | 6.729 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 549.0559 |
| Heavy Atoms | 36 |
| Complexity | 1517.246 |
Chemical Identifiers
| CAS Number | 315694-11-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)NC5=CC(=C(C=C5)Cl)C(F)(F)F |
Product Overview
AF-399/15128605 (CAS 315694-11-2), with molecular formula C25H19ClF3N3O2S2 and molecular weight 549.06 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of AF-399/15128605
Property Insights of AF-399/15128605
The XLogP value of 6.729 indicates that AF-399/15128605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15128605. Following Lipinski's Rule of Five, AF-399/15128605 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15128605?
The CAS number of AF-399/15128605 is 315694-11-2.
What is the molecular formula of AF-399/15128605?
The molecular formula of AF-399/15128605 is C25H19ClF3N3O2S2.
What is the molecular weight of AF-399/15128605?
The molecular weight of AF-399/15128605 is 549.06 g/mol.
Where can I buy AF-399/15128605?
You can request a quote for AF-399/15128605 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15128605?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15128605 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.