2-(3-methoxyphenyl)-1-{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one
2-(3-methoxyphenyl)-1-{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | P936-3072 |
| Compound Name: | 2-(3-methoxyphenyl)-1-{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C22 H24 N4 O2 |
| Smiles: | COc1cccc(CC(N2CCC(Cc3nncn3c3ccccc3)C2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9576 |
| logD: | 2.9576 |
| logSw: | -3.3511 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.722 |
| InChI Key: | WYEQTWACNLOITL-SFHVURJKSA-N |