3,5-bis{[(4-tert-butylphenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
Chemical Structure Depiction of
3,5-bis{[(4-tert-butylphenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
3,5-bis{[(4-tert-butylphenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8006-4516 |
| Compound Name: | 3,5-bis{[(4-tert-butylphenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile |
| Molecular Weight: | 466.73 |
| Molecular Formula: | C26 H30 N2 S3 |
| Smiles: | CC(C)(C)c1ccc(CSc2c(C#N)c(SCc3ccc(cc3)C(C)(C)C)sn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 8.6196 |
| logD: | 8.6196 |
| logSw: | -6.1281 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.3745 |
| InChI Key: | KMFCRNFGXPULRL-UHFFFAOYSA-N |