N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide
Compound characteristics
| Compound ID: | F644-0031 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}propanamide |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C26 H34 N6 O3 |
| Smiles: | Cc1c(CCC(NCCc2ccc(c(c2)OC)OC)=O)c(C)n(c2cc(ncn2)N2CCCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8437 |
| logD: | 2.8098 |
| logSw: | -3.3008 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.514 |
| InChI Key: | YQCYUPLNDAVOJG-UHFFFAOYSA-N |