N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromofuran-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromofuran-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromofuran-2-carboxamide
Compound characteristics
| Compound ID: | 8012-0695 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromofuran-2-carboxamide |
| Molecular Weight: | 324.13 |
| Molecular Formula: | C13 H10 Br N O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc(o1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6212 |
| logD: | 2.6212 |
| logSw: | -2.9335 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.693 |
| InChI Key: | ITMBMDTZZZBFSV-UHFFFAOYSA-N |