2-{[3-(2H-1,3-benzodioxol-5-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-chlorophenyl)acetamide
Chemical Structure Depiction of
2-{[3-(2H-1,3-benzodioxol-5-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-chlorophenyl)acetamide
2-{[3-(2H-1,3-benzodioxol-5-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | K284-2273 |
| Compound Name: | 2-{[3-(2H-1,3-benzodioxol-5-yl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-chlorophenyl)acetamide |
| Molecular Weight: | 465.91 |
| Molecular Formula: | C23 H16 Cl N3 O4 S |
| Smiles: | C1Oc2ccc(cc2O1)N1C(=Nc2ccccc2C1=O)SCC(Nc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5809 |
| logD: | 3.5808 |
| logSw: | -3.907 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.727 |
| InChI Key: | UCUXZODVRYSALP-UHFFFAOYSA-N |