4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[2-(4-fluorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butan-1-one
Chemical Structure Depiction of
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[2-(4-fluorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butan-1-one
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[2-(4-fluorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butan-1-one
Compound characteristics
| Compound ID: | P218-3780 |
| Compound Name: | 4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[2-(4-fluorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butan-1-one |
| Molecular Weight: | 505.55 |
| Molecular Formula: | C27 H28 F N5 O4 |
| Smiles: | COc1ccc(cc1OC)c1nc(CCCC(N2CCCn3c(C2)cc(c2ccc(cc2)F)n3)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.1114 |
| logD: | 4.1114 |
| logSw: | -4.3327 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.493 |
| InChI Key: | BPZYQXNVRNACDF-UHFFFAOYSA-N |