N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | E686-0171 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-2-oxo-1-oxaspiro[4.6]undec-3-ene-4-carboxamide |
| Molecular Weight: | 401.81 |
| Molecular Formula: | C19 H19 Cl F3 N O3 |
| Smiles: | CC1=C(C(Nc2cc(ccc2[Cl])C(F)(F)F)=O)C2(CCCCCC2)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 5.1213 |
| logD: | 4.4966 |
| logSw: | -5.6849 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.788 |
| InChI Key: | AQGBKGJLRQZGHS-UHFFFAOYSA-N |