N-butyl-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-butyl-2H-1,3-benzodioxole-5-carboxamide
N-butyl-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y030-3134 |
| Compound Name: | N-butyl-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 221.25 |
| Molecular Formula: | C12 H15 N O3 |
| Smiles: | CCCCNC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4217 |
| logD: | 2.4217 |
| logSw: | -2.9132 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.88 |
| InChI Key: | FQGXZBMAADGBOL-UHFFFAOYSA-N |