2-{[(4-tert-butylbenzene-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(4-tert-butylbenzene-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
2-{[(4-tert-butylbenzene-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4378-0290 |
| Compound Name: | 2-{[(4-tert-butylbenzene-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 488.69 |
| Molecular Formula: | C27 H24 N2 O S3 |
| Smiles: | CC(C)(C)c1ccc(cc1)S(CSc1c(C#N)c(cc(c2cccs2)n1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 8.2093 |
| logD: | 8.2093 |
| logSw: | -5.9576 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.658 |
| InChI Key: | HBRXWDZIILGSEF-UHFFFAOYSA-N |