3-[4-(4-ethoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
Chemical Structure Depiction of
3-[4-(4-ethoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
3-[4-(4-ethoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-2176 |
| Compound Name: | 3-[4-(4-ethoxybenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-(2-methoxyethyl)pyrrolidin-2-one |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C20 H31 N3 O5 S |
| Smiles: | CCOc1ccc(cc1)S(N1CCCN(CC1)C1CCN(CCOC)C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2897 |
| logD: | 1.2892 |
| logSw: | -2.4482 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.348 |
| InChI Key: | FKCWAMKKOGCSNB-IBGZPJMESA-N |