ChemDiv3_012623
TL;DR: ChemDiv3_012623 (CAS 957948-84-4) is a chemical compound with molecular formula C25H18FN3O2S and molecular weight 443.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-5-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-2H-imidazo[1,2-c]quinazolin-3-one
Also Known As: ChemDiv3_012623, BRD-A25591268-001-01-1, F6548-3564, 2-benzyl-5-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-2H-imidazo[1,2-c]quinazolin-3-one, 2-benzyl-5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-2H,3H-imidazo[1,2-c]quinazolin-3-one
| Molecular Formula | C25H18FN3O2S |
|---|---|
| Molecular Weight | 443.11 g/mol |
| LogP | 4.643 |
| Topological Polar Surface Area | 62.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.11038 |
| Heavy Atoms | 32 |
| Complexity | 1255.6934 |
Chemical Identifiers
| CAS Number | 957948-84-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC(=O)C5=CC=C(C=C5)F |
Product Overview
ChemDiv3_012623 (CAS 957948-84-4), with molecular formula C25H18FN3O2S and molecular weight 443.11 g/mol. IUPAC: 2-benzyl-5-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-2H-imidazo[1,2-c]quinazolin-3-one.
Chemical Property Profile of ChemDiv3_012623
Property Insights of ChemDiv3_012623
The XLogP value of 4.643 indicates that ChemDiv3_012623 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012623. Following Lipinski's Rule of Five, ChemDiv3_012623 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_012623?
The CAS number of ChemDiv3_012623 is 957948-84-4.
What is the molecular formula of ChemDiv3_012623?
The molecular formula of ChemDiv3_012623 is C25H18FN3O2S.
What is the molecular weight of ChemDiv3_012623?
The molecular weight of ChemDiv3_012623 is 443.11 g/mol.
Where can I buy ChemDiv3_012623?
You can request a quote for ChemDiv3_012623 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012623?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012623 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.