F0863-0498
TL;DR: F0863-0498 (CAS 315693-90-4) is a chemical compound with molecular formula C29H22FN3O4S2 and molecular weight 559.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-fluorophenyl)-2-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate
Also Known As: F0863-0498, AF-399/15128589, ethyl 4-(4-fluorophenyl)-2-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate, ethyl 4-(4-fluorophenyl)-2-(2-((4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)thio)acetamido)thiophene-3-carboxylate, ethyl 4-(4-fluorophenyl)-2-{2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamido}thiophene-3-carboxylate
| Molecular Formula | C29H22FN3O4S2 |
|---|---|
| Molecular Weight | 559.10 g/mol |
| LogP | 6.1608 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 559.1036 |
| Heavy Atoms | 39 |
| Complexity | 1716.9231 |
Chemical Identifiers
| CAS Number | 315693-90-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5 |
Product Overview
F0863-0498 (CAS 315693-90-4), with molecular formula C29H22FN3O4S2 and molecular weight 559.10 g/mol. IUPAC: ethyl 4-(4-fluorophenyl)-2-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of F0863-0498
Property Insights of F0863-0498
The XLogP value of 6.1608 indicates that F0863-0498 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F0863-0498. Following Lipinski's Rule of Five, F0863-0498 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0863-0498?
The CAS number of F0863-0498 is 315693-90-4.
What is the molecular formula of F0863-0498?
The molecular formula of F0863-0498 is C29H22FN3O4S2.
What is the molecular weight of F0863-0498?
The molecular weight of F0863-0498 is 559.10 g/mol.
Where can I buy F0863-0498?
You can request a quote for F0863-0498 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0863-0498?
Yes, KEHONG BIO provides custom synthesis services for F0863-0498 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.