2-(3-chlorophenyl)-1-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-1-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidin-1-yl}ethan-1-one
2-(3-chlorophenyl)-1-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S460-0975 |
| Compound Name: | 2-(3-chlorophenyl)-1-{3-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 398.85 |
| Molecular Formula: | C19 H19 Cl N6 O2 |
| Smiles: | C1CN(CC1n1cc(c2nc(C3CC3)no2)nn1)C(Cc1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0371 |
| logD: | 3.0371 |
| logSw: | -3.2858 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.594 |
| InChI Key: | AQVMHOSBTBOHPQ-OAHLLOKOSA-N |