2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(4-nitrophenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(4-nitrophenyl)methylidene]acetohydrazide
2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(4-nitrophenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 2088-0014 |
| Compound Name: | 2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(4-nitrophenyl)methylidene]acetohydrazide |
| Molecular Weight: | 437.48 |
| Molecular Formula: | C21 H19 N5 O4 S |
| Smiles: | CC(=C)CN1C(=Nc2ccccc2C1=O)SCC(N/N=C/c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4037 |
| logD: | 3.4036 |
| logSw: | -3.9353 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.798 |
| InChI Key: | PDXNMBFTRRMHKC-UHFFFAOYSA-N |