N-[6-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[6-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[6-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0391 |
| Compound Name: | N-[6-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 571.62 |
| Molecular Formula: | C23 H31 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1cc(C(N2CCCC2)=O)c(nc1)N1CCNCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2105 |
| logD: | 1.7325 |
| logSw: | -3.5194 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.386 |
| InChI Key: | MYVAYUYSHHUOKZ-UHFFFAOYSA-N |