TL;DR: (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide (CAS 1173661-44-3) is a chemical compound with molecular formula C17H13Cl2N3O2 and molecular weight 361.03848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3-yl)propanamide
Also Known As: (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3-yl)propanamide, (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide, (S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide
| Molecular Formula | C17H13Cl2N3O2 |
| Molecular Weight | 361.03848 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.03848 Da |
| Heavy Atoms | 24 |
| Complexity | 518.0 |
| SMILES | C[C@@H](C(=O)NC1=CC(=CC(=C1)Cl)Cl)N2C=NC3=CC=CC=C3C2=O |
| InChIKey | BWKFDTROHYUGNE-JTQLQIEISA-N |
The XLogP value of 3.4 indicates that (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide. Following Lipinski's Rule of Five, (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide is 1173661-44-3.
The molecular formula of (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide is C17H13Cl2N3O2.
The molecular weight of (2S)-N-(3,5-dichlorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide is 361.03848 g/mol.
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