N-(4-ethylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-(4-ethylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0100 |
| Compound Name: | N-(4-ethylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 417.5 |
| Molecular Formula: | C26 H27 N O4 |
| Smiles: | CCc1ccc(cc1)NC(c1c(C)c2c3C(CC4(CCCCC4)Oc3ccc2o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9092 |
| logD: | 5.909 |
| logSw: | -5.8123 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.839 |
| InChI Key: | GMDBLJKICDIZPU-UHFFFAOYSA-N |