2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(cyclohex-1-en-1-yl)ethyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(cyclohex-1-en-1-yl)ethyl]quinazolin-4(3H)-one
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(cyclohex-1-en-1-yl)ethyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0553 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(cyclohex-1-en-1-yl)ethyl]quinazolin-4(3H)-one |
| Molecular Weight: | 483.43 |
| Molecular Formula: | C24 H23 Br N2 O2 S |
| Smiles: | C1CCC(CCN2C(=Nc3ccccc3C2=O)SCC(c2ccc(cc2)[Br])=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.4818 |
| logD: | 5.4818 |
| logSw: | -5.6689 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.188 |
| InChI Key: | RJKVPNDYHBPXFT-UHFFFAOYSA-N |