5-[(4-bromobenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
5-[(4-bromobenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0005 |
| Compound Name: | 5-[(4-bromobenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-2-(piperazin-1-yl)pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 612.42 |
| Molecular Formula: | C19 H24 Br N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | COCCNC(c1cc(cnc1N1CCNCC1)NS(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2276 |
| logD: | 0.7496 |
| logSw: | -3.0388 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.24 |
| InChI Key: | OHJCHXUILDEBLP-UHFFFAOYSA-N |