N-[(5-tert-butyl-2,3-dihydro-1-benzofuran-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(5-tert-butyl-2,3-dihydro-1-benzofuran-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
N-[(5-tert-butyl-2,3-dihydro-1-benzofuran-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V030-9342 |
| Compound Name: | N-[(5-tert-butyl-2,3-dihydro-1-benzofuran-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C21 H23 N O4 |
| Smiles: | CC(C)(C)c1ccc2c(CC(CNC(c3ccc4c(c3)OCO4)=O)O2)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3554 |
| logD: | 4.3554 |
| logSw: | -4.3762 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.363 |
| InChI Key: | GPHUIMGHEUVEKN-UHFFFAOYSA-N |