1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butane-1,4-dione
Chemical Structure Depiction of
1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butane-1,4-dione
1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butane-1,4-dione
Compound characteristics
| Compound ID: | P218-0535 |
| Compound Name: | 1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]butane-1,4-dione |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C24 H24 F N3 O3 |
| Smiles: | COc1ccc(cc1)c1cc2CN(CCCn2n1)C(CCC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4015 |
| logD: | 3.4015 |
| logSw: | -3.8258 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.68 |
| InChI Key: | KRAXKKKBJOZPEF-UHFFFAOYSA-N |