N-[(2,3-dimethoxyphenyl)methyl]-1',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-1',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-[(2,3-dimethoxyphenyl)methyl]-1',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0501 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-1',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 477.56 |
| Molecular Formula: | C28 H31 N O6 |
| Smiles: | CC1CCC2(CC1)CC(c1c(ccc3c1c(C)c(C(NCc1cccc(c1OC)OC)=O)o3)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3151 |
| logD: | 5.315 |
| logSw: | -5.6037 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.509 |
| InChI Key: | QVYQMYQQDNORIZ-UHFFFAOYSA-N |