5-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-diethyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-diethyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
5-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-diethyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0276 |
| Compound Name: | 5-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-diethyl-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 559.61 |
| Molecular Formula: | C22 H31 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)C(c1cc(cnc1N1CCNCC1)NS(c1cc(C)ccc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.576 |
| logD: | 1.0979 |
| logSw: | -2.99 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.304 |
| InChI Key: | CEXJCPLLGBCXDJ-UHFFFAOYSA-N |