5-acetamido-N-butyl-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-acetamido-N-butyl-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
5-acetamido-N-butyl-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L347-0286 |
| Compound Name: | 5-acetamido-N-butyl-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 447.46 |
| Molecular Formula: | C17 H27 N5 O2 |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(cnc1N1CCNCC1)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8526 |
| logD: | -0.6254 |
| logSw: | -2.1414 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.384 |
| InChI Key: | PAOVFQOIKOKYHA-UHFFFAOYSA-N |