N-butyl-N-methyl-5-(2-methylbenzamido)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-N-methyl-5-(2-methylbenzamido)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
N-butyl-N-methyl-5-(2-methylbenzamido)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L347-0100 |
| Compound Name: | N-butyl-N-methyl-5-(2-methylbenzamido)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 523.55 |
| Molecular Formula: | C23 H31 N5 O2 |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(cnc1N1CCNCC1)NC(c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7014 |
| logD: | 1.2233 |
| logSw: | -3.2057 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.214 |
| InChI Key: | SLPJUSTWWBMELC-UHFFFAOYSA-N |