2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-N-[(oxolan-2-yl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-N-[(oxolan-2-yl)methyl]pyridine-3-carboxamide
2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-N-[(oxolan-2-yl)methyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V018-5573 |
| Compound Name: | 2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-N-[(oxolan-2-yl)methyl]pyridine-3-carboxamide |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C21 H32 N4 O3 |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(CC(C)(C)C)=O)c1c(cccn1)C(NCC1CCCO1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2063 |
| logD: | 2.2061 |
| logSw: | -2.7782 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.94 |
| InChI Key: | AJEBOYQKVFJSKO-MRXNPFEDSA-N |