N,N-dimethyl-3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N,N-dimethyl-3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N,N-dimethyl-3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0391 |
| Compound Name: | N,N-dimethyl-3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-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)Cc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6178 |
| logD: | 2.6178 |
| logSw: | -3.2315 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.303 |
| InChI Key: | KQRYONFZCCXJEO-UHFFFAOYSA-N |