3-[4-(4-phenylpiperazine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[4-(4-phenylpiperazine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[4-(4-phenylpiperazine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K288-0607 |
| Compound Name: | 3-[4-(4-phenylpiperazine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C25 H22 N4 O2 S |
| Smiles: | C1CN(CCN1C(c1ccc(cc1)N1C(c2ccccc2NC1=S)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4153 |
| logD: | 3.4095 |
| logSw: | -3.8507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.615 |
| InChI Key: | KPGWTYKIINZLAT-UHFFFAOYSA-N |