N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-nitrophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-nitrophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-nitrophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V019-3975 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-nitrophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 463.45 |
| Molecular Formula: | C23 H21 N5 O6 |
| Salt: | not_available |
| Smiles: | C1CN(Cc2c(C(NCc3ccc4c(c3)OCO4)=O)n[nH]c12)C(Cc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3288 |
| logD: | 2.3288 |
| logSw: | -2.9396 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.663 |
| InChI Key: | CYFDBNYVGFKWSI-UHFFFAOYSA-N |