N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0485 |
| Compound Name: | N-butyl-N-methyl-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 600.7 |
| Molecular Formula: | C26 H38 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(ccc1N1CCNCC1)NS(c1ccc(CC(C)C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4112 |
| logD: | 2.9356 |
| logSw: | -4.0841 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.401 |
| InChI Key: | BXOXFEHWBFCAKO-UHFFFAOYSA-N |