2-({4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}carbamoyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
2-({4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}carbamoyl)cyclohexane-1-carboxylic acid
2-({4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}carbamoyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | 8018-6766 |
| Compound Name: | 2-({4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}carbamoyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C21 H21 N O6 |
| Smiles: | C1CCC(C(C1)C(O)=O)C(Nc1ccc(cc1)Oc1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5653 |
| logD: | 0.9146 |
| logSw: | -3.5632 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.793 |
| InChI Key: | PTZGWQRPRYQGKN-UHFFFAOYSA-N |