7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-1885 |
| Compound Name: | 7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C24 H21 Cl N4 O3 S |
| Smiles: | C1CN(CCN1C(c1ccc2C(N(Cc3ccco3)C(Nc2c1)=S)=O)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8793 |
| logD: | 3.8791 |
| logSw: | -4.399 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.975 |
| InChI Key: | TYOQSLLSTNAHMU-UHFFFAOYSA-N |