2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4,6-di(thiophen-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4,6-di(thiophen-2-yl)pyridine-3-carbonitrile
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4,6-di(thiophen-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8002-7089 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4,6-di(thiophen-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 497.45 |
| Molecular Formula: | C22 H13 Br N2 O S3 |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)Sc1c(C#N)c(cc(c2cccs2)n1)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 7.0233 |
| logD: | 7.0233 |
| logSw: | -6.1363 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.511 |
| InChI Key: | BXRMKLHSQCSKNS-UHFFFAOYSA-N |