N-(2-cyanoethyl)-N-methyl-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-N-methyl-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
N-(2-cyanoethyl)-N-methyl-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C618-0843 |
| Compound Name: | N-(2-cyanoethyl)-N-methyl-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide |
| Molecular Weight: | 324.34 |
| Molecular Formula: | C17 H16 N4 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(cnn1CC(N(C)CCC#N)=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 0.9272 |
| logD: | 0.9272 |
| logSw: | -2.1495 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.095 |
| InChI Key: | OFCPQQIFBAYHQI-UHFFFAOYSA-N |