1-(2-methoxyethyl)-3-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Chemical Structure Depiction of
1-(2-methoxyethyl)-3-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
1-(2-methoxyethyl)-3-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-2157 |
| Compound Name: | 1-(2-methoxyethyl)-3-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C19 H29 N3 O4 S |
| Smiles: | Cc1cccc(c1)S(N1CCCN(CC1)C1CCN(CCOC)C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3455 |
| logD: | 1.3451 |
| logSw: | -2.3184 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.224 |
| InChI Key: | KWFDHEUGUHVTBL-SFHVURJKSA-N |