methyl ({5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
methyl ({5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
methyl ({5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y205-7299 |
| Compound Name: | methyl ({5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C17 H21 N3 O3 S |
| Smiles: | Cn1c(c2ccc(cc2)OC2CCCC2)nnc1SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8753 |
| logD: | 2.8752 |
| logSw: | -3.1634 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.721 |
| InChI Key: | FIJKNNZRYZACRY-UHFFFAOYSA-N |