methyl 2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamamido}benzoate
methyl 2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | Y205-2325 |
| Compound Name: | methyl 2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamamido}benzoate |
| Molecular Weight: | 328.32 |
| Molecular Formula: | C17 H16 N2 O5 |
| Smiles: | COC(c1ccccc1NC(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5266 |
| logD: | 2.5258 |
| logSw: | -3.1297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.455 |
| InChI Key: | BTFIGONHUHNPAI-UHFFFAOYSA-N |