5-[4-(2-chloroethyl)benzoyl]-N-(2-methylbutyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
5-[4-(2-chloroethyl)benzoyl]-N-(2-methylbutyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
5-[4-(2-chloroethyl)benzoyl]-N-(2-methylbutyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V008-8110 |
| Compound Name: | 5-[4-(2-chloroethyl)benzoyl]-N-(2-methylbutyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 402.92 |
| Molecular Formula: | C21 H27 Cl N4 O2 |
| Smiles: | CCC(C)CNC(c1c2CN(CCc2[nH]n1)C(c1ccc(CC[Cl])cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9861 |
| logD: | 2.9861 |
| logSw: | -3.3423 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.266 |
| InChI Key: | CAVCQUZGNFHWEK-AWEZNQCLSA-N |