N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-3,4-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-3,4-dimethoxybenzene-1-sulfonamide
N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-3,4-dimethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | S925-0638 |
| Compound Name: | N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-3,4-dimethoxybenzene-1-sulfonamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C21 H28 N4 O5 S |
| Smiles: | C[C@H]1C(N(C)C[C@@H](CNS(c2ccc(c(c2)OC)OC)(=O)=O)N1Cc1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.5297 |
| logD: | 0.5294 |
| logSw: | -2.126 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.595 |
| InChI Key: | QYQJOCDOKWYJSK-DOTOQJQBSA-N |