N-(3-acetylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-(3-acetylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0137 |
| Compound Name: | N-(3-acetylphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C26 H25 N O5 |
| Smiles: | CC(c1cccc(c1)NC(c1c(C)c2c3C(CC4(CCCCC4)Oc3ccc2o1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7195 |
| logD: | 4.7104 |
| logSw: | -4.9003 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.666 |
| InChI Key: | CEALPGDWPKZSDV-UHFFFAOYSA-N |