N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-6-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-6-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-6-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L477-0414 |
| Compound Name: | N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-6-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 601.69 |
| Molecular Formula: | C25 H37 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(c(nc1)N1CCNCC1)NS(c1ccc(CC(C)C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7675 |
| logD: | 3.7675 |
| logSw: | -3.7958 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.074 |
| InChI Key: | RDTFXGABRWRRJO-UHFFFAOYSA-N |