7-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-3-propyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
7-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-3-propyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
7-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-3-propyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K288-0361 |
| Compound Name: | 7-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-3-propyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C23 H23 N3 O2 S |
| Smiles: | CCCN1C(c2ccc(cc2NC1=S)C(N1CCC(=CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.13 |
| logD: | 4.1295 |
| logSw: | -4.0895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.945 |
| InChI Key: | FTKXVRWNVCGELS-UHFFFAOYSA-N |