2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-bromo-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-bromo-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-bromo-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-1204 |
| Compound Name: | 2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-6-bromo-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one |
| Molecular Weight: | 539.45 |
| Molecular Formula: | C26 H23 Br N2 O4 S |
| Smiles: | CC(c1ccc(c(CSC2=Nc3ccc(cc3C(N2Cc2ccccc2OC)=O)[Br])c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5043 |
| logD: | 5.5043 |
| logSw: | -5.3494 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.859 |
| InChI Key: | CEVKELDLZAIPAI-UHFFFAOYSA-N |