5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-N-(3-methoxypropyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-N-(3-methoxypropyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-N-(3-methoxypropyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0373 |
| Compound Name: | 5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-N-(3-methoxypropyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 575.61 |
| Molecular Formula: | C22 H31 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1C)S(Nc1cc(C(NCCCOC)=O)c(nc1)N1CCNCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.522 |
| logD: | 1.0439 |
| logSw: | -2.9934 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.24 |
| InChI Key: | AEWWTIVHGOHFNL-UHFFFAOYSA-N |