N-cyclopentyl-2,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopentyl-2,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclopentyl-2,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0182 |
| Compound Name: | N-cyclopentyl-2,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 507.57 |
| Molecular Formula: | C20 H31 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(C)c(c1)S(N(CCC(N1CCNCC1)=O)C1CCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0938 |
| logD: | 1.2658 |
| logSw: | -2.8046 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.323 |
| InChI Key: | XBSXOMITRJMKNE-UHFFFAOYSA-N |