N-(2,2-dimethyl-2H-1,3-benzodioxol-5-yl)-3-nitropyridin-2-amine
Chemical Structure Depiction of
N-(2,2-dimethyl-2H-1,3-benzodioxol-5-yl)-3-nitropyridin-2-amine
N-(2,2-dimethyl-2H-1,3-benzodioxol-5-yl)-3-nitropyridin-2-amine
Compound characteristics
| Compound ID: | 8017-3857 |
| Compound Name: | N-(2,2-dimethyl-2H-1,3-benzodioxol-5-yl)-3-nitropyridin-2-amine |
| Molecular Weight: | 287.27 |
| Molecular Formula: | C14 H13 N3 O4 |
| Smiles: | CC1(C)Oc2ccc(cc2O1)Nc1c(cccn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9629 |
| logD: | 2.9629 |
| logSw: | -3.4033 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.818 |
| InChI Key: | CTCLFGMWEFMSHV-UHFFFAOYSA-N |