N-(2-iodophenyl)-3,8-dimethyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
Chemical Structure Depiction of
N-(2-iodophenyl)-3,8-dimethyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
N-(2-iodophenyl)-3,8-dimethyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | C533-1061 |
| Compound Name: | N-(2-iodophenyl)-3,8-dimethyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide |
| Molecular Weight: | 425.26 |
| Molecular Formula: | C18 H20 I N O3 |
| Smiles: | CC1CCC2(CC1)C(=C(C)C(=O)O2)C(Nc1ccccc1I)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2663 |
| logD: | 4.2608 |
| logSw: | -4.2773 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.457 |
| InChI Key: | FVXHZYYUXYMJTI-UHFFFAOYSA-N |