3-(5-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(5-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
3-(5-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0100 |
| Compound Name: | 3-(5-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 452.9 |
| Molecular Formula: | C22 H21 Cl N6 O3 |
| Smiles: | C1CCN(C1)C(CCn1c2ccc(cc2nn1)c1nc(COc2ccc(cc2)[Cl])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6516 |
| logD: | 3.6516 |
| logSw: | -4.2408 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.972 |
| InChI Key: | QTJPDCFXWQJEIU-UHFFFAOYSA-N |