3-(4-methoxyphenyl)-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
3-(4-methoxyphenyl)-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | S517-0211 |
| Compound Name: | 3-(4-methoxyphenyl)-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | COc1ccc(CCC(N2CCC(CC2)Cc2nncn2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4698 |
| logD: | 3.4696 |
| logSw: | -3.6392 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.423 |
| InChI Key: | GOTGQPPLAJLWCQ-UHFFFAOYSA-N |