1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propan-1-one
Compound characteristics
| Compound ID: | C614-6475 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-(2,4-dimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-3-yl)propan-1-one |
| Molecular Weight: | 472.55 |
| Molecular Formula: | C26 H28 N6 O3 |
| Smiles: | Cc1c(CCC(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)c(C)n2c(c3cccnc3n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.0419 |
| logD: | 1.6976 |
| logSw: | -2.6832 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.405 |
| InChI Key: | HSWAIQBFHNCCNO-UHFFFAOYSA-N |