(S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide
TL;DR: (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide (CAS 1173686-63-9) is a chemical compound with molecular formula C17H13BrFN3O3 and molecular weight 405.01242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
Also Known As: (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide, (2S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide, (2S)-N-(4-bromo-2-fluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Technical Specifications
| Molecular Formula | C17H13BrFN3O3 |
| Molecular Weight | 405.01242 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.01242 Da |
| Heavy Atoms | 25 |
| Complexity | 561.0 |
| SMILES | C[C@@H](C(=O)NC1=C(C=C(C=C1)Br)F)N2C(=O)C3=CC=CC=C3NC2=O |
| InChIKey | HZGCILOYMYKSPI-VIFPVBQESA-N |
Chemical Property Profile of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide
Property Insights of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide. Following Lipinski's Rule of Five, (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide has 2 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 (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide?
The CAS number of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide is 1173686-63-9.
What is the molecular formula of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide?
The molecular formula of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide is C17H13BrFN3O3.
What is the molecular weight of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide?
The molecular weight of (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide is 405.01242 g/mol.
Where can I buy (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide?
You can request a quote for (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide?
Yes, CoreyChem provides custom synthesis services for (S)-N-(4-bromo-2-fluorophenyl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.