F0916-6294
TL;DR: F0916-6294 (CAS 422529-49-5) is a chemical compound with molecular formula C21H18ClN5O2S and molecular weight 439.08698 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-chlorophenyl)methyl]-N-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
Also Known As: F0916-6294, 3-[(4-chlorophenyl)methyl]-N-[2-(1H-imidazol-4-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide, 3-[(4-chlorophenyl)methyl]-N-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide, 3-(4-chlorobenzyl)-N-[2-(1H-imidazol-4-yl)ethyl]-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide, N-(2-(1H-imidazol-4-yl)ethyl)-3-(4-chlorobenzyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Technical Specifications
| Molecular Formula | C21H18ClN5O2S |
| Molecular Weight | 439.08698 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.08698 Da |
| Heavy Atoms | 30 |
| Complexity | 657.0 |
| SMILES | C1=CC(=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)NCCC4=CN=CN4)NC2=S)Cl |
| InChIKey | OHLJPZVVVOPQEM-UHFFFAOYSA-N |
Chemical Property Profile of F0916-6294
Property Insights of F0916-6294
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0916-6294. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-6294. Following Lipinski's Rule of Five, F0916-6294 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of F0916-6294?
The CAS number of F0916-6294 is 422529-49-5.
What is the molecular formula of F0916-6294?
The molecular formula of F0916-6294 is C21H18ClN5O2S.
What is the molecular weight of F0916-6294?
The molecular weight of F0916-6294 is 439.08698 g/mol.
Where can I buy F0916-6294?
You can request a quote for F0916-6294 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0916-6294?
Yes, CoreyChem provides custom synthesis services for F0916-6294 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.