N-[2-(4-fluoroanilino)-2-oxoethyl]-N,1-dimethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-fluoroanilino)-2-oxoethyl]-N,1-dimethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
N-[2-(4-fluoroanilino)-2-oxoethyl]-N,1-dimethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | S397-0080 |
| Compound Name: | N-[2-(4-fluoroanilino)-2-oxoethyl]-N,1-dimethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 346.36 |
| Molecular Formula: | C17 H19 F N4 O3 |
| Smiles: | CN(CC(Nc1ccc(cc1)F)=O)C(c1c2COCCc2n(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5944 |
| logD: | 0.5943 |
| logSw: | -1.9955 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.883 |
| InChI Key: | SOHORUYOSPGPGM-UHFFFAOYSA-N |