J3.560.509F
TL;DR: J3.560.509F (CAS 797017-59-5) is a chemical compound with molecular formula C26H18ClFN2S and molecular weight 444.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(4-chlorophenyl)-11-(4-fluorophenyl)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene
Also Known As: J3.560.509F, 9-(4-chlorophenyl)-7-(4-fluorophenyl)-6,7-dihydro-5H-benzo[h]thiazolo[2,3-b]quinazoline, 13-(4-chlorophenyl)-11-(4-fluorophenyl)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene, 3-(4-Chlorophenyl)-5-(4-fluorophenyl)-8,9-[1,3]butadieno-6,7-dihydro-5H-thiazolo[2,3-b]quinazoline, 9-(4-chlorophenyl)-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazoline
| Molecular Formula | C26H18ClFN2S |
|---|---|
| Molecular Weight | 444.09 g/mol |
| LogP | 7.2947 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 444.08633 |
| Heavy Atoms | 31 |
| Complexity | 1275.5189 |
Chemical Identifiers
| CAS Number | 797017-59-5 |
|---|---|
| SMILES | C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=C(C=C5)F)C(=CS4)C6=CC=C(C=C6)Cl |
Product Overview
J3.560.509F (CAS 797017-59-5), with molecular formula C26H18ClFN2S and molecular weight 444.09 g/mol. IUPAC: 13-(4-chlorophenyl)-11-(4-fluorophenyl)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene.
Chemical Property Profile of J3.560.509F
Property Insights of J3.560.509F
The XLogP value of 7.2947 indicates that J3.560.509F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, J3.560.509F exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J3.560.509F has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J3.560.509F?
The CAS number of J3.560.509F is 797017-59-5.
What is the molecular formula of J3.560.509F?
The molecular formula of J3.560.509F is C26H18ClFN2S.
What is the molecular weight of J3.560.509F?
The molecular weight of J3.560.509F is 444.09 g/mol.
Where can I buy J3.560.509F?
You can request a quote for J3.560.509F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.560.509F?
Yes, KEHONG BIO provides custom synthesis services for J3.560.509F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.