N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | J035-0424 |
| Compound Name: | N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C26 H31 F N6 O2 |
| Smiles: | CC1(C)CC2=C(C=Nc3c(cnn23)C(NCCCN2CCN(CC2)c2ccccc2F)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9323 |
| logD: | 2.6311 |
| logSw: | -3.5201 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.846 |
| InChI Key: | BTYIGAOKLFOBCZ-UHFFFAOYSA-N |