1'-methyl-9'-oxo-N-[3-(trifluoromethyl)phenyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
1'-methyl-9'-oxo-N-[3-(trifluoromethyl)phenyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
1'-methyl-9'-oxo-N-[3-(trifluoromethyl)phenyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0056 |
| Compound Name: | 1'-methyl-9'-oxo-N-[3-(trifluoromethyl)phenyl]-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 457.45 |
| Molecular Formula: | C25 H22 F3 N O4 |
| Smiles: | Cc1c2c3C(CC4(CCCCC4)Oc3ccc2oc1C(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0218 |
| logD: | 5.9793 |
| logSw: | -5.8865 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.839 |
| InChI Key: | ILEOGAJNJHIJCU-UHFFFAOYSA-N |