N-[(3-methylphenyl)methyl]-5-(4-nitrobenzoyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-5-(4-nitrobenzoyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
N-[(3-methylphenyl)methyl]-5-(4-nitrobenzoyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V025-2708 |
| Compound Name: | N-[(3-methylphenyl)methyl]-5-(4-nitrobenzoyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C22 H21 N5 O4 |
| Salt: | not_available |
| Smiles: | Cc1cccc(CNC(c2c3CN(CCc3[nH]n2)C(c2ccc(cc2)[N+]([O-])=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.617 |
| logD: | 2.6169 |
| logSw: | -2.8607 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.376 |
| InChI Key: | NQQZDYSAQKRRJR-UHFFFAOYSA-N |