N-[(3-chlorophenyl)methyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide
N-[(3-chlorophenyl)methyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | E686-0179 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide |
| Molecular Weight: | 347.84 |
| Molecular Formula: | C19 H22 Cl N O3 |
| Smiles: | CC1=C(C(NCc2cccc(c2)[Cl])=O)C2(CCCCCC2)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.0964 |
| logD: | 4.0964 |
| logSw: | -4.4636 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.808 |
| InChI Key: | BTYQUUYRQYBCOE-UHFFFAOYSA-N |