N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-1077 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 461.51 |
| Molecular Formula: | C27 H27 N O6 |
| Smiles: | Cc1c2c3C(CC4(CCCCCC4)Oc3ccc2oc1C(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4471 |
| logD: | 4.4435 |
| logSw: | -4.8267 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.993 |
| InChI Key: | JCTZTSBIWSUWCK-UHFFFAOYSA-N |