N-cyclopentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzenesulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzenesulfonamide--trifluoroacetic acid (1/1)
N-cyclopentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzenesulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L127-0116 |
| Compound Name: | N-cyclopentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzenesulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 515.57 |
| Molecular Formula: | C17 H27 N3 O4 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CCC(C1)N(CCS(N1CCNCC1)(=O)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0819 |
| logD: | 0.7372 |
| logSw: | -2.1166 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.807 |
| InChI Key: | VCDJDQFOJNEJKX-UHFFFAOYSA-N |