N-(2-methylpropyl)-2-(piperazin-1-yl)-5-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(2-methylpropyl)-2-(piperazin-1-yl)-5-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-(2-methylpropyl)-2-(piperazin-1-yl)-5-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0378 |
| Compound Name: | N-(2-methylpropyl)-2-(piperazin-1-yl)-5-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 584.66 |
| Molecular Formula: | C25 H34 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)CNC(c1cc(ccc1N1CCNCC1)NS(c1ccc2CCCCc2c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0939 |
| logD: | 2.6184 |
| logSw: | -4.1565 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.606 |
| InChI Key: | YYGKMHXHJQSBLO-UHFFFAOYSA-N |