N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3,5-dimethyl-1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3,5-dimethyl-1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3,5-dimethyl-1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide
Compound characteristics
| Compound ID: | F644-0487 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3,5-dimethyl-1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide |
| Molecular Weight: | 464.52 |
| Molecular Formula: | C24 H28 N6 O4 |
| Smiles: | Cc1c(CCC(NCc2ccc3c(c2)OCO3)=O)c(C)n(c2cc(ncn2)N2CCOCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7417 |
| logD: | 2.7077 |
| logSw: | -3.1519 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.07 |
| InChI Key: | JBAJCFODYVDHHV-UHFFFAOYSA-N |