2-(6-nitro-2H-1,3-benzodioxol-5-yl)-3-phenyl-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
2-(6-nitro-2H-1,3-benzodioxol-5-yl)-3-phenyl-2,3-dihydroquinazolin-4(1H)-one
2-(6-nitro-2H-1,3-benzodioxol-5-yl)-3-phenyl-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | 8011-1366 |
| Compound Name: | 2-(6-nitro-2H-1,3-benzodioxol-5-yl)-3-phenyl-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | C1Oc2cc(C3Nc4ccccc4C(N3c3ccccc3)=O)c(cc2O1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8645 |
| logD: | 3.8645 |
| logSw: | -4.2485 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.927 |
| InChI Key: | REXLDFGVCFKFPF-FQEVSTJZSA-N |