2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-4(3H)-one
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K289-0526 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-4(3H)-one |
| Molecular Weight: | 564.46 |
| Molecular Formula: | C27 H22 Br N3 O4 S |
| Smiles: | C1COCCN1C(c1ccc(cc1)N1C(=Nc2ccccc2C1=O)SCC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2888 |
| logD: | 3.2885 |
| logSw: | -3.8853 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.963 |
| InChI Key: | LVAYQHOJPWYORM-UHFFFAOYSA-N |