N-(5-chloro-2,4-dimethoxyphenyl)-1',4-dimethyl-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',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-1',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0341 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-1',4-dimethyl-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 497.98 |
| Molecular Formula: | C27 H28 Cl N O6 |
| Smiles: | CC1CCC2(CC1)CC(c1c(ccc3c1c(C)c(C(Nc1cc(c(cc1OC)OC)[Cl])=O)o3)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9983 |
| logD: | 5.5509 |
| logSw: | -6.4045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.402 |
| InChI Key: | PZBXFSZOXSVSPT-UHFFFAOYSA-N |