3-{5-[5-(2-bromophenyl)-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-bromophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one
3-{5-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0093 |
| Compound Name: | 3-{5-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 467.32 |
| Molecular Formula: | C21 H19 Br N6 O2 |
| Smiles: | C1CCN(C1)C(CCn1c2ccc(cc2nn1)c1nc(c2ccccc2[Br])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4795 |
| logD: | 3.4795 |
| logSw: | -3.7703 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.807 |
| InChI Key: | XKXSCZXXWAVGBS-UHFFFAOYSA-N |