N'-[(5-bromo-2-hydroxyphenyl)methylidene]-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Chemical Structure Depiction of
N'-[(5-bromo-2-hydroxyphenyl)methylidene]-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
N'-[(5-bromo-2-hydroxyphenyl)methylidene]-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Compound characteristics
| Compound ID: | 2088-0016 |
| Compound Name: | N'-[(5-bromo-2-hydroxyphenyl)methylidene]-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide |
| Molecular Weight: | 487.37 |
| Molecular Formula: | C21 H19 Br N4 O3 S |
| Smiles: | CC(=C)CN1C(=Nc2ccccc2C1=O)SCC(N/N=C/c1cc(ccc1O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2949 |
| logD: | 4.2923 |
| logSw: | -3.9685 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.965 |
| InChI Key: | HRPOGKNKRFUTNO-UHFFFAOYSA-N |