1-(2-methoxyethyl)-3-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Chemical Structure Depiction of
1-(2-methoxyethyl)-3-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
1-(2-methoxyethyl)-3-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-2196 |
| Compound Name: | 1-(2-methoxyethyl)-3-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C22 H35 N3 O4 S |
| Smiles: | Cc1cc(C)c(C)c(c1C)S(N1CCCN(CC1)C1CCN(CCOC)C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5535 |
| logD: | 2.5531 |
| logSw: | -2.5807 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.224 |
| InChI Key: | FGGNOYOKLFSOGA-FQEVSTJZSA-N |