4-methyl-3-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-methyl-3-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole
4-methyl-3-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-5263 |
| Compound Name: | 4-methyl-3-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 438.63 |
| Molecular Formula: | C22 H22 N4 S3 |
| Smiles: | Cc1cccc(c1)c1nc(CSc2nnc(c3csc4CCCCc34)n2C)cs1 |
| Stereo: | ACHIRAL |
| logP: | 6.2247 |
| logD: | 6.2223 |
| logSw: | -5.7786 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.219 |
| InChI Key: | ARMRSONORRBCRS-UHFFFAOYSA-N |