3-{[(2-hydroxy-3-nitrophenyl)methyl]amino}-2-methylquinazolin-4(3H)-one
Chemical Structure Depiction of
3-{[(2-hydroxy-3-nitrophenyl)methyl]amino}-2-methylquinazolin-4(3H)-one
3-{[(2-hydroxy-3-nitrophenyl)methyl]amino}-2-methylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 3470-5637 |
| Compound Name: | 3-{[(2-hydroxy-3-nitrophenyl)methyl]amino}-2-methylquinazolin-4(3H)-one |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C16 H14 N4 O4 |
| Smiles: | CC1=Nc2ccccc2C(N1NCc1cccc(c1O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.668 |
| logD: | 1.4363 |
| logSw: | -2.4962 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.472 |
| InChI Key: | XLXSGFINVIETJR-UHFFFAOYSA-N |