2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(3,3-diethoxypropyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(3,3-diethoxypropyl)quinazolin-4(3H)-one
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(3,3-diethoxypropyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-4589 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(3,3-diethoxypropyl)quinazolin-4(3H)-one |
| Molecular Weight: | 505.43 |
| Molecular Formula: | C23 H25 Br N2 O4 S |
| Smiles: | CCOC(CCN1C(=Nc2ccccc2C1=O)SCC(c1ccc(cc1)[Br])=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.1234 |
| logD: | 4.1234 |
| logSw: | -4.2179 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.922 |
| InChI Key: | BFASSFVOUNHAJB-UHFFFAOYSA-N |