N-[4-(butan-2-yl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[4-(butan-2-yl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y030-3124 |
| Compound Name: | N-[4-(butan-2-yl)phenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 297.35 |
| Molecular Formula: | C18 H19 N O3 |
| Smiles: | CCC(C)c1ccc(cc1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8714 |
| logD: | 4.8713 |
| logSw: | -4.556 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.445 |
| InChI Key: | JTGQAAPTNDYCBW-LBPRGKRZSA-N |