AN-988/14419091
TL;DR: AN-988/14419091 (CAS 496914-08-0) is a chemical compound with molecular formula C25H16Cl2N2O2S2 and molecular weight 510.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(14E)-14-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-11-thiophen-2-yl-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,16-pentaen-13-one
Also Known As: AN-988/14419091, 10-(3,5-dichloro-2-hydroxybenzylidene)-7-(2-thienyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one, (14E)-14-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-11-thiophen-2-yl-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,16-pentaen-13-one
| Molecular Formula | C25H16Cl2N2O2S2 |
|---|---|
| Molecular Weight | 510.00 g/mol |
| LogP | 5.3926 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 510.00302 |
| Heavy Atoms | 33 |
| Complexity | 1631.7296 |
Chemical Identifiers
| CAS Number | 496914-08-0 |
|---|---|
| SMILES | C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=CS5)C(=O)/C(=C\C6=C(C(=CC(=C6)Cl)Cl)O)/S4 |
Product Overview
AN-988/14419091 (CAS 496914-08-0), with molecular formula C25H16Cl2N2O2S2 and molecular weight 510.00 g/mol. IUPAC: (14E)-14-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-11-thiophen-2-yl-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,16-pentaen-13-one.
Chemical Property Profile of AN-988/14419091
Property Insights of AN-988/14419091
The XLogP value of 5.3926 indicates that AN-988/14419091 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.59 Ų, AN-988/14419091 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-988/14419091 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 AN-988/14419091?
The CAS number of AN-988/14419091 is 496914-08-0.
What is the molecular formula of AN-988/14419091?
The molecular formula of AN-988/14419091 is C25H16Cl2N2O2S2.
What is the molecular weight of AN-988/14419091?
The molecular weight of AN-988/14419091 is 510.00 g/mol.
Where can I buy AN-988/14419091?
You can request a quote for AN-988/14419091 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/14419091?
Yes, KEHONG BIO provides custom synthesis services for AN-988/14419091 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.