3-({[2-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-cyclopentyl-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-({[2-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-cyclopentyl-4-methyl-4H-1,2,4-triazole
3-({[2-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-cyclopentyl-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6040 |
| Compound Name: | 3-({[2-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-cyclopentyl-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 400.52 |
| Molecular Formula: | C19 H20 N4 O2 S2 |
| Smiles: | Cn1c(C2CCCC2)nnc1SCc1csc(c2ccc3c(c2)OCO3)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7989 |
| logD: | 4.7983 |
| logSw: | -4.6253 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.954 |
| InChI Key: | GCFSQWJPUMIKNG-UHFFFAOYSA-N |