2-{[5-(2H-1,3-benzodioxol-5-yl)-2H-tetrazol-2-yl]methyl}quinazolin-4(1H)-one
Chemical Structure Depiction of
2-{[5-(2H-1,3-benzodioxol-5-yl)-2H-tetrazol-2-yl]methyl}quinazolin-4(1H)-one
2-{[5-(2H-1,3-benzodioxol-5-yl)-2H-tetrazol-2-yl]methyl}quinazolin-4(1H)-one
Compound characteristics
| Compound ID: | 8017-4954 |
| Compound Name: | 2-{[5-(2H-1,3-benzodioxol-5-yl)-2H-tetrazol-2-yl]methyl}quinazolin-4(1H)-one |
| Molecular Weight: | 348.32 |
| Molecular Formula: | C17 H12 N6 O3 |
| Smiles: | C(C1Nc2ccccc2C(N=1)=O)n1nc(c2ccc3c(c2)OCO3)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.0352 |
| logD: | 2.029 |
| logSw: | -3.1442 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.391 |
| InChI Key: | XAXKIMMJAKGAKT-UHFFFAOYSA-N |