7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenylquinazolin-4(3H)-one
Chemical Structure Depiction of
7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenylquinazolin-4(3H)-one
7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | A0015589 |
| Compound Name: | 7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenylquinazolin-4(3H)-one |
| Molecular Weight: | 531.63 |
| Molecular Formula: | C32 H25 N3 O3 S |
| Smiles: | C1CN(Cc2ccccc12)C(c1ccc2C(N(C(=Nc2c1)SCC(c1ccccc1)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4932 |
| logD: | 4.4927 |
| logSw: | -4.4257 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.717 |
| InChI Key: | DVUIVPSBGUNHMV-UHFFFAOYSA-N |