3,5-bis{[(2-chlorophenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
Chemical Structure Depiction of
3,5-bis{[(2-chlorophenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
3,5-bis{[(2-chlorophenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8006-4476 |
| Compound Name: | 3,5-bis{[(2-chlorophenyl)methyl]sulfanyl}-1,2-thiazole-4-carbonitrile |
| Molecular Weight: | 423.4 |
| Molecular Formula: | C18 H12 Cl2 N2 S3 |
| Smiles: | C(c1ccccc1[Cl])Sc1c(C#N)c(SCc2ccccc2[Cl])sn1 |
| Stereo: | ACHIRAL |
| logP: | 6.9033 |
| logD: | 6.9033 |
| logSw: | -6.9272 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.3745 |
| InChI Key: | REODECXRFOYDFP-UHFFFAOYSA-N |