TL;DR: 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid (CAS 1396967-11-5) is a chemical compound with molecular formula C11H11N3O3 and molecular weight 233.08005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-2-(quinazolin-4-ylamino)propanoic acid
Also Known As: n-quinazolin-4-ylserine, 3-hydroxy-2-(quinazolin-4-ylamino)propanoic acid, N-(4-quinazolinyl)serine, BAS 01292581, 3-Hydroxy-2-(quinazolin-4-ylamino)-propionic acid
| Molecular Formula | C11H11N3O3 |
| Molecular Weight | 233.08005 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 95.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.08005 Da |
| Heavy Atoms | 17 |
| Complexity | 275.0 |
| SMILES | C1=CC=C2C(=C1)C(=NC=N2)NC(CO)C(=O)O |
| InChIKey | TXYSJLZWDLBWSA-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid. Following Lipinski's Rule of Five, 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid is 1396967-11-5.
The molecular formula of 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid is C11H11N3O3.
The molecular weight of 3-Hydroxy-2-(quinazolin-4-ylamino)propanoic acid is 233.08005 g/mol.
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