6-(4-bromophenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-phenylpyridine-3-carbonitrile
Chemical Structure Depiction of
6-(4-bromophenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-phenylpyridine-3-carbonitrile
6-(4-bromophenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-phenylpyridine-3-carbonitrile
Compound characteristics
Compound ID: | 8001-8166 |
Compound Name: | 6-(4-bromophenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-phenylpyridine-3-carbonitrile |
Molecular Weight: | 465.41 |
Molecular Formula: | C24 H21 Br N2 O S |
Smiles: | CC(C)(C)C(CSc1c(C#N)c(cc(c2ccc(cc2)[Br])n1)c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 7.5633 |
logD: | 7.5633 |
logSw: | -5.7554 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 38.746 |
InChI Key: | PNHZEWGVVCJONU-UHFFFAOYSA-N |