N-(5-chloro-2,4-dimethoxyphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0083 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 483.95 |
| Molecular Formula: | C26 H26 Cl N O6 |
| Smiles: | Cc1c2c3C(CC4(CCCCC4)Oc3ccc2oc1C(Nc1cc(c(cc1OC)OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4756 |
| logD: | 5.0281 |
| logSw: | -6.2424 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.402 |
| InChI Key: | XVWTYFVVAFSPIW-UHFFFAOYSA-N |