(4-methoxyphenyl){3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}methanone
Chemical Structure Depiction of
(4-methoxyphenyl){3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}methanone
(4-methoxyphenyl){3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}methanone
Compound characteristics
| Compound ID: | P936-3076 |
| Compound Name: | (4-methoxyphenyl){3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}methanone |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C21 H22 N4 O2 |
| Smiles: | COc1ccc(cc1)C(N1CCC(Cc2nncn2c2ccccc2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5284 |
| logD: | 2.5284 |
| logSw: | -2.5537 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.25 |
| InChI Key: | DQYLKKRVYFFZSP-INIZCTEOSA-N |