methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamamido]benzoate
Chemical Structure Depiction of
methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamamido]benzoate
methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamamido]benzoate
Compound characteristics
| Compound ID: | Y206-3039 |
| Compound Name: | methyl 4-[(2H-1,3-benzodioxol-5-yl)carbamamido]benzoate |
| Molecular Weight: | 314.3 |
| Molecular Formula: | C16 H14 N2 O5 |
| Smiles: | COC(c1ccc(cc1)NC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5953 |
| logD: | 3.5953 |
| logSw: | -3.7218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.831 |
| InChI Key: | NKQJJKADPMKXFO-UHFFFAOYSA-N |