N-[2-(azepan-1-yl)pyrimidin-5-yl]-1-ethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)pyrimidin-5-yl]-1-ethyl-1H-pyrazole-5-carboxamide
N-[2-(azepan-1-yl)pyrimidin-5-yl]-1-ethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | P209-0693 |
| Compound Name: | N-[2-(azepan-1-yl)pyrimidin-5-yl]-1-ethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C16 H22 N6 O |
| Smiles: | CCn1c(ccn1)C(Nc1cnc(nc1)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1116 |
| logD: | 2.1049 |
| logSw: | -2.7451 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.744 |
| InChI Key: | PFSYVDBYSDIWCV-UHFFFAOYSA-N |