TL;DR: (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide (CAS 1173684-43-9) is a chemical compound with molecular formula C18H14N4O3S and molecular weight 366.07867 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(1,3-benzothiazol-2-yl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
Also Known As: (S)-N-(benzo[d]thiazol-2-yl)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide, (2S)-N-(1,3-benzothiazol-2-yl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide, (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
| Molecular Formula | C18H14N4O3S |
| Molecular Weight | 366.07867 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.07867 Da |
| Heavy Atoms | 26 |
| Complexity | 601.0 |
| SMILES | C[C@@H](C(=O)NC1=NC2=CC=CC=C2S1)N3C(=O)C4=CC=CC=C4NC3=O |
| InChIKey | UWXFBCUVPCNHQB-JTQLQIEISA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide. Following Lipinski's Rule of Five, (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is 1173684-43-9.
The molecular formula of (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is C18H14N4O3S.
The molecular weight of (2S)-N-(1,3-benzothiazol-2-yl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide is 366.07867 g/mol.
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