N-[3-(azepan-1-yl)propyl]-1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
N-[3-(azepan-1-yl)propyl]-1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | L090-0668 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 442.95 |
| Molecular Formula: | C22 H27 Cl N6 O2 |
| Smiles: | CN1C=Nc2c(C(NCCCN3CCCCCC3)=O)nn(c3ccc(cc3)[Cl])c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.9393 |
| logD: | -0.6314 |
| logSw: | -2.8537 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.895 |
| InChI Key: | UNXFIFFBEMIQFG-UHFFFAOYSA-N |