2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(morpholine-4-carbonyl)-3-(2-phenylethyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(morpholine-4-carbonyl)-3-(2-phenylethyl)quinazolin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(morpholine-4-carbonyl)-3-(2-phenylethyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | A0016031 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(morpholine-4-carbonyl)-3-(2-phenylethyl)quinazolin-4(3H)-one |
| Molecular Weight: | 520.05 |
| Molecular Formula: | C28 H26 Cl N3 O3 S |
| Smiles: | C(CN1C(=Nc2cc(ccc2C1=O)C(N1CCOCC1)=O)SCc1cccc(c1)[Cl])c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5125 |
| logD: | 4.5125 |
| logSw: | -4.5969 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.306 |
| InChI Key: | IAUUCSXXXRDHKL-UHFFFAOYSA-N |