{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methoxyphenyl)methanone
Chemical Structure Depiction of
{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methoxyphenyl)methanone
{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | S517-0899 |
| Compound Name: | {4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methoxyphenyl)methanone |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C23 H26 N4 O2 |
| Smiles: | COc1cccc(c1)C(N1CCC(CC1)Cc1nncn1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9025 |
| logD: | 2.9024 |
| logSw: | -3.3422 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.491 |
| InChI Key: | GNGYJRRRCASODG-UHFFFAOYSA-N |