N-(2-methoxy-4-nitrophenyl)-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
N-(2-methoxy-4-nitrophenyl)-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G365-0431 |
| Compound Name: | N-(2-methoxy-4-nitrophenyl)-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 366.33 |
| Molecular Formula: | C18 H14 N4 O5 |
| Smiles: | COc1cc(ccc1NC(c1c2COc3ccccc3c2[nH]n1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1429 |
| logD: | 2.7491 |
| logSw: | -3.6974 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.135 |
| InChI Key: | MHSKGXYORFWPEN-UHFFFAOYSA-N |