1-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]piperidine-4-carboxylic acid
Chemical Structure Depiction of
1-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]piperidine-4-carboxylic acid
1-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]piperidine-4-carboxylic acid
Compound characteristics
| Compound ID: | Y040-4038 |
| Compound Name: | 1-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]piperidine-4-carboxylic acid |
| Molecular Weight: | 411.45 |
| Molecular Formula: | C23 H25 N O6 |
| Smiles: | CC1=C(CC(N2CCC(CC2)C(O)=O)=O)C(=O)Oc2c1cc1c(C)c(C)oc1c2C |
| Stereo: | ACHIRAL |
| logP: | 2.565 |
| logD: | 0.012 |
| logSw: | -2.694 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.554 |
| InChI Key: | ORNLFLKKVARRMQ-UHFFFAOYSA-N |