1-(4-bromophenyl)-3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one
Chemical Structure Depiction of
1-(4-bromophenyl)-3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one
1-(4-bromophenyl)-3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0822 |
| Compound Name: | 1-(4-bromophenyl)-3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one |
| Molecular Weight: | 429.33 |
| Molecular Formula: | C20 H17 Br N2 O2 S |
| Smiles: | Cc1ccc(C(CSC2C(N(C=CN=2)c2ccc(cc2)[Br])=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.193 |
| logD: | 4.193 |
| logSw: | -4.323 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.89 |
| InChI Key: | PQNQQDWSPPFDPK-UHFFFAOYSA-N |