3-(5-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(5-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
3-(5-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0057 |
| Compound Name: | 3-(5-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 448.91 |
| Molecular Formula: | C23 H21 Cl N6 O2 |
| Smiles: | C1CCN(C1)C(CCn1c2ccc(cc2nn1)c1nc(/C=C/c2ccccc2[Cl])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.532 |
| logD: | 4.532 |
| logSw: | -4.6323 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.473 |
| InChI Key: | WHGHOMGCJWHMPC-UHFFFAOYSA-N |