3-[(4-methoxyphenoxy)methyl]-4-methyl-5-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[(4-methoxyphenoxy)methyl]-4-methyl-5-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4H-1,2,4-triazole
3-[(4-methoxyphenoxy)methyl]-4-methyl-5-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y207-4498 |
| Compound Name: | 3-[(4-methoxyphenoxy)methyl]-4-methyl-5-({[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 438.57 |
| Molecular Formula: | C22 H22 N4 O2 S2 |
| Smiles: | Cc1cccc(c1)c1nc(CSc2nnc(COc3ccc(cc3)OC)n2C)cs1 |
| Stereo: | ACHIRAL |
| logP: | 4.8373 |
| logD: | 4.8373 |
| logSw: | -4.7246 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.299 |
| InChI Key: | YFLFDMPWWQRVBR-UHFFFAOYSA-N |