N-(4-{[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]sulfamoyl}phenyl)acetamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(4-{[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]sulfamoyl}phenyl)acetamide--trifluoroacetic acid (1/1)
N-(4-{[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]sulfamoyl}phenyl)acetamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0097 |
| Compound Name: | N-(4-{[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]sulfamoyl}phenyl)acetamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 585.6 |
| Molecular Formula: | C23 H29 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CC(Nc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N1CCCC1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1668 |
| logD: | 1.1668 |
| logSw: | -2.4555 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.579 |
| InChI Key: | OOECGZSQIMWQNJ-UHFFFAOYSA-N |