C27H17FN4O6S
TL;DR: C27H17FN4O6S (CAS 370091-25-1) is a chemical compound with molecular formula C27H17FN4O6S and molecular weight 544.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(14Z)-11-(4-fluorophenyl)-14-[(4-hydroxy-3,5-dinitrophenyl)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-fluorophenyl)-10-(4-hydroxy-3,5-dinitrobenzylidene)-7,10-dihydro-5H-benzo[h]thiazolo[2,3-b]quinazolin-9(6H)-one
| Molecular Formula | C27H17FN4O6S |
|---|---|
| Molecular Weight | 544.09 g/mol |
| LogP | 3.9798 |
| Topological Polar Surface Area | 140.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 544.08527 |
| Heavy Atoms | 39 |
| Complexity | 1891.7064 |
Chemical Identifiers
| CAS Number | 370091-25-1 |
|---|---|
| SMILES | C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=C(C=C5)F)C(=O)/C(=C/C6=CC(=C(C(=C6)[N+](=O)[O-])O)[N+](=O)[O-])/S4 |
Product Overview
C27H17FN4O6S (CAS 370091-25-1), with molecular formula C27H17FN4O6S and molecular weight 544.09 g/mol. IUPAC: (14Z)-11-(4-fluorophenyl)-14-[(4-hydroxy-3,5-dinitrophenyl)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 C27H17FN4O6S
Property Insights of C27H17FN4O6S
The XLogP value of 3.9798 indicates that C27H17FN4O6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.87 Ų indicates high polarity, suggesting C27H17FN4O6S may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C27H17FN4O6S has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C27H17FN4O6S?
The CAS number of C27H17FN4O6S is 370091-25-1.
What is the molecular formula of C27H17FN4O6S?
The molecular formula of C27H17FN4O6S is C27H17FN4O6S.
What is the molecular weight of C27H17FN4O6S?
The molecular weight of C27H17FN4O6S is 544.09 g/mol.
Where can I buy C27H17FN4O6S?
You can request a quote for C27H17FN4O6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H17FN4O6S?
Yes, KEHONG BIO provides custom synthesis services for C27H17FN4O6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.