1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxopyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxopyrrolidine-3-carboxylic acid
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxopyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | 8015-6295 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxopyrrolidine-3-carboxylic acid |
| Molecular Weight: | 263.25 |
| Molecular Formula: | C13 H13 N O5 |
| Smiles: | C1C(CN(Cc2ccc3c(c2)OCO3)C1=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0253 |
| logD: | -2.5743 |
| logSw: | -1.6175 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.958 |
| InChI Key: | QPPHUXXOFJHSIQ-SECBINFHSA-N |