N-(3-chloro-4-fluorophenyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2H-1,3-benzodioxole-5-carboxamide
N-(3-chloro-4-fluorophenyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y030-3151 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 293.68 |
| Molecular Formula: | C14 H9 Cl F N O3 |
| Smiles: | C1Oc2ccc(cc2O1)C(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6735 |
| logD: | 3.6361 |
| logSw: | -4.2083 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.445 |
| InChI Key: | DMNSGHHYFFIIPO-UHFFFAOYSA-N |