N-[5-(2-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[5-(2-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[5-(2-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0403 |
| Compound Name: | N-[5-(2-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 599.67 |
| Molecular Formula: | C25 H35 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1cc(C(N2CCCCC2C)=O)c(nc1)N1CCNCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8732 |
| logD: | 2.3951 |
| logSw: | -3.7227 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.305 |
| InChI Key: | PWMORVZLBYINJN-IBGZPJMESA-N |