2-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
2-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]cyclohexane-1-carboxylic acid
2-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y204-5773 |
| Compound Name: | 2-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]cyclohexane-1-carboxylic acid |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C17 H19 N O6 |
| Smiles: | CC(c1cc2c(cc1NC(C1CCCCC1C(O)=O)=O)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9213 |
| logD: | -0.7294 |
| logSw: | -2.7041 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.174 |
| InChI Key: | SJFFAEVYLTVACK-UHFFFAOYSA-N |