4-{2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl}-N,N-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-{2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl}-N,N-dimethylbenzene-1-sulfonamide
4-{2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl}-N,N-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4341-0541 |
| Compound Name: | 4-{2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl}-N,N-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 517.6 |
| Molecular Formula: | C25 H31 N3 O7 S |
| Smiles: | CN(C)CCN1C(C(=C(C1=O)O)C(c1ccc(cc1)S(N(C)C)(=O)=O)=O)c1ccc(c(c1)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6481 |
| logD: | 0.8159 |
| logSw: | -2.605 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.867 |
| InChI Key: | PTRGKFPDXAMVQF-JOCHJYFZSA-N |