3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-(2-methylpropyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-(2-methylpropyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-(2-methylpropyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F919-1098 |
Compound Name: | 3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-(2-methylpropyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 558.62 |
Molecular Formula: | C23 H32 N4 O3 S |
Salt: | CF3COOH |
Smiles: | CC(C)CNC(c1ccc(c(c1)NS(c1cc(C)ccc1C)(=O)=O)N1CCNCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.2727 |
logD: | 3.2727 |
logSw: | -3.5691 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 79.987 |
InChI Key: | SLLGVUAVPCEKKZ-UHFFFAOYSA-N |