3-{5-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-{5-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one
3-{5-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0111 |
| Compound Name: | 3-{5-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 468.31 |
| Molecular Formula: | C20 H18 Br N7 O2 |
| Smiles: | C1CCN(C1)C(CCn1c2ccc(cc2nn1)c1nc(c2cc(cnc2)[Br])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0527 |
| logD: | 3.0527 |
| logSw: | -3.0886 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 83.414 |
| InChI Key: | DPHQLZKNZBAHKA-UHFFFAOYSA-N |