N-[2-hydroxy-3-(pyrrolidin-1-yl)propyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-hydroxy-3-(pyrrolidin-1-yl)propyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzene-1-sulfonamide
N-[2-hydroxy-3-(pyrrolidin-1-yl)propyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4013-1430 |
| Compound Name: | N-[2-hydroxy-3-(pyrrolidin-1-yl)propyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 449.52 |
| Molecular Formula: | C21 H27 N3 O6 S |
| Smiles: | Cc1ccc(cc1)S(N(CC(CN1CCCC1)O)c1cc(ccc1OC)[N+]([O-])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7861 |
| logD: | 1.5274 |
| logSw: | -3.2823 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.493 |
| InChI Key: | LSDQSMRWLYTOOD-GOSISDBHSA-N |