1'-methyl-9'-oxo-N-({4-[(propan-2-yl)oxy]phenyl}methyl)-8',9'-dihydrospiro[cyclopentane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
1'-methyl-9'-oxo-N-({4-[(propan-2-yl)oxy]phenyl}methyl)-8',9'-dihydrospiro[cyclopentane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
1'-methyl-9'-oxo-N-({4-[(propan-2-yl)oxy]phenyl}methyl)-8',9'-dihydrospiro[cyclopentane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0933 |
| Compound Name: | 1'-methyl-9'-oxo-N-({4-[(propan-2-yl)oxy]phenyl}methyl)-8',9'-dihydrospiro[cyclopentane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C27 H29 N O5 |
| Smiles: | CC(C)Oc1ccc(CNC(c2c(C)c3c4C(CC5(CCCC5)Oc4ccc3o2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7338 |
| logD: | 4.7338 |
| logSw: | -4.9261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.33 |
| InChI Key: | PLNYMLDZYWUELV-UHFFFAOYSA-N |