7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3-(2-phenylethyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3-(2-phenylethyl)quinazolin-4(3H)-one
7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3-(2-phenylethyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | A0015911 |
| Compound Name: | 7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3-(2-phenylethyl)quinazolin-4(3H)-one |
| Molecular Weight: | 530.6 |
| Molecular Formula: | C28 H26 N4 O5 S |
| Smiles: | C(CN1C(=Nc2cc(ccc2C1=O)C(N1CCOCC1)=O)SCc1cccc(c1)[N+]([O-])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7192 |
| logD: | 3.7192 |
| logSw: | -4.1095 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.688 |
| InChI Key: | XLVHXUJFAUYTSO-UHFFFAOYSA-N |