3-{5-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(morpholin-4-yl)propan-1-one
Chemical Structure Depiction of
3-{5-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(morpholin-4-yl)propan-1-one
3-{5-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(morpholin-4-yl)propan-1-one
Compound characteristics
Compound ID: | L701-0598 |
Compound Name: | 3-{5-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}-1-(morpholin-4-yl)propan-1-one |
Molecular Weight: | 422.42 |
Molecular Formula: | C21 H19 F N6 O3 |
Smiles: | C(Cn1c2ccc(cc2nn1)c1nc(c2ccc(cc2)F)on1)C(N1CCOCC1)=O |
Stereo: | ACHIRAL |
logP: | 2.3506 |
logD: | 2.3506 |
logSw: | -2.6958 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 81.35 |
InChI Key: | PXZYNODYSGNAIC-UHFFFAOYSA-N |