ethyl 2-{[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]carbamamido}benzoate
Chemical Structure Depiction of
ethyl 2-{[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]carbamamido}benzoate
ethyl 2-{[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]carbamamido}benzoate
Compound characteristics
| Compound ID: | F107-1956 |
| Compound Name: | ethyl 2-{[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]carbamamido}benzoate |
| Molecular Weight: | 490.51 |
| Molecular Formula: | C27 H26 N2 O7 |
| Smiles: | CCOC(c1ccccc1NC(NC(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3872 |
| logD: | 5.3831 |
| logSw: | -5.4619 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.787 |
| InChI Key: | ONAGHBKHTBNDCY-UHFFFAOYSA-N |