3-[(benzenesulfonyl)amino]-N-butyl-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(benzenesulfonyl)amino]-N-butyl-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(benzenesulfonyl)amino]-N-butyl-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0072 |
| Compound Name: | 3-[(benzenesulfonyl)amino]-N-butyl-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 544.59 |
| Molecular Formula: | C22 H30 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1ccc(c(c1)NS(c1ccccc1)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2104 |
| logD: | 2.2104 |
| logSw: | -3.1856 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.703 |
| InChI Key: | ITEGABHBEHOGMC-UHFFFAOYSA-N |