N-benzyl-2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]acetamide
N-benzyl-2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | S421-0013 |
| Compound Name: | N-benzyl-2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | C1CN(CC1CC(NCc1ccccc1)=O)S(c1ccc2c(c1)OCCO2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7603 |
| logD: | 1.7603 |
| logSw: | -2.7132 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.272 |
| InChI Key: | JVRHODGEMPYARV-KRWDZBQOSA-N |