2-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-4,5,6-trimethylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-4,5,6-trimethylpyridine-3-carbonitrile
2-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-4,5,6-trimethylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 3368-0630 |
| Compound Name: | 2-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-4,5,6-trimethylpyridine-3-carbonitrile |
| Molecular Weight: | 430.32 |
| Molecular Formula: | C19 H16 Br N3 O2 S |
| Smiles: | Cc1c(C)c(C)nc(c1C#N)SC1CC(N(C1=O)c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7973 |
| logD: | 3.7973 |
| logSw: | -4.2688 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.538 |
| InChI Key: | LOVNDAPDWGHAES-MRXNPFEDSA-N |