N-(2-cyanoethyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-phenylacetamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-phenylacetamide
N-(2-cyanoethyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-phenylacetamide
Compound characteristics
| Compound ID: | C660-0234 |
| Compound Name: | N-(2-cyanoethyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-phenylacetamide |
| Molecular Weight: | 372.38 |
| Molecular Formula: | C21 H16 N4 O3 |
| Smiles: | C(CN(C(Cn1c2c3ccccc3OC(c2cn1)=O)=O)c1ccccc1)C#N |
| Stereo: | ACHIRAL |
| logP: | 2.085 |
| logD: | 2.085 |
| logSw: | -2.9385 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.295 |
| InChI Key: | LXLFNNKFIFYVKF-UHFFFAOYSA-N |