3-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | C270-0361 |
| Compound Name: | 3-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 428.98 |
| Molecular Formula: | C22 H25 Cl N4 O S |
| Smiles: | Cc1ccc(cc1N1CCN(CCCN2C(c3ccccc3NC2=S)=O)CC1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6495 |
| logD: | 3.6392 |
| logSw: | -4.6447 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.238 |
| InChI Key: | VADWMRGMHGNSDY-UHFFFAOYSA-N |