N-[(4-methoxyphenyl)methyl]-3-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-3-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide
N-[(4-methoxyphenyl)methyl]-3-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P937-3949 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-3-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C21 H24 N6 O2 |
| Smiles: | COc1ccc(CNC(N2CCC(Cc3nnc(c4ccncc4)[nH]3)C2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.886 |
| logD: | 1.8627 |
| logSw: | -1.923 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.805 |
| InChI Key: | LSOOKHGELKFBHO-INIZCTEOSA-N |