C27H18ClFN2OS
TL;DR: C27H18ClFN2OS (CAS 710304-80-6) is a chemical compound with molecular formula C27H18ClFN2OS and molecular weight 472.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(14Z)-11-(4-chlorophenyl)-14-[(4-fluorophenyl)methylidene]-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: (Z)-7-(4-chlorophenyl)-10-(4-fluorobenzylidene)-7,10-dihydro-5H-benzo[h]thiazolo[2,3-b]quinazolin-9(6H)-one
| Molecular Formula | C27H18ClFN2OS |
|---|---|
| Molecular Weight | 472.08 g/mol |
| LogP | 5.1112 |
| Topological Polar Surface Area | 34.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.08124 |
| Heavy Atoms | 33 |
| Complexity | 1597.8123 |
Chemical Identifiers
| CAS Number | 710304-80-6 |
|---|---|
| SMILES | C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=C(C=C5)Cl)C(=O)/C(=C/C6=CC=C(C=C6)F)/S4 |
Product Overview
C27H18ClFN2OS (CAS 710304-80-6), with molecular formula C27H18ClFN2OS and molecular weight 472.08 g/mol. IUPAC: (14Z)-11-(4-chlorophenyl)-14-[(4-fluorophenyl)methylidene]-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 C27H18ClFN2OS
Property Insights of C27H18ClFN2OS
The XLogP value of 5.1112 indicates that C27H18ClFN2OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.36 Ų, C27H18ClFN2OS exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C27H18ClFN2OS 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 C27H18ClFN2OS?
The CAS number of C27H18ClFN2OS is 710304-80-6.
What is the molecular formula of C27H18ClFN2OS?
The molecular formula of C27H18ClFN2OS is C27H18ClFN2OS.
What is the molecular weight of C27H18ClFN2OS?
The molecular weight of C27H18ClFN2OS is 472.08 g/mol.
Where can I buy C27H18ClFN2OS?
You can request a quote for C27H18ClFN2OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H18ClFN2OS?
Yes, KEHONG BIO provides custom synthesis services for C27H18ClFN2OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.