N-[(2H-1,3-benzodioxol-5-yl)methyl][1,2,4]triazolo[4,3-c]quinazolin-5-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl][1,2,4]triazolo[4,3-c]quinazolin-5-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl][1,2,4]triazolo[4,3-c]quinazolin-5-amine
Compound characteristics
| Compound ID: | E973-0394 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl][1,2,4]triazolo[4,3-c]quinazolin-5-amine |
| Molecular Weight: | 319.32 |
| Molecular Formula: | C17 H13 N5 O2 |
| Smiles: | C(c1ccc2c(c1)OCO2)Nc1nc2ccccc2c2nncn12 |
| Stereo: | ACHIRAL |
| logP: | 2.3248 |
| logD: | 2.3122 |
| logSw: | -2.8752 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.135 |
| InChI Key: | ROMLYZQADVZLEN-UHFFFAOYSA-N |