3-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | C270-0427 |
| Compound Name: | 3-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 408.56 |
| Molecular Formula: | C23 H28 N4 O S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CCCN2C(c3ccccc3NC2=S)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.5249 |
| logD: | 3.5145 |
| logSw: | -4.183 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.238 |
| InChI Key: | VLSOADMBKSVONF-UHFFFAOYSA-N |