N-cycloheptyl-2-fluoro-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cycloheptyl-2-fluoro-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-cycloheptyl-2-fluoro-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0084 |
| Compound Name: | N-cycloheptyl-2-fluoro-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 525.56 |
| Molecular Formula: | C20 H30 F N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | C1CCCC(CC1)N(CCS(N1CCNCC1)(=O)=O)C(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3998 |
| logD: | 2.0551 |
| logSw: | -2.9378 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.569 |
| InChI Key: | NPZDGMQNPXRVBZ-UHFFFAOYSA-N |