N-butyl-5-[(4-chlorobenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-5-[(4-chlorobenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
N-butyl-5-[(4-chlorobenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0024 |
| Compound Name: | N-butyl-5-[(4-chlorobenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 580.03 |
| Molecular Formula: | C21 H28 Cl N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(cnc1N1CCNCC1)NS(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.901 |
| logD: | 1.4229 |
| logSw: | -3.6108 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.772 |
| InChI Key: | ADXFWXJEUWHXIS-UHFFFAOYSA-N |