N-(butan-2-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
N-(butan-2-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-1002 |
| Compound Name: | N-(butan-2-yl)-1'-methyl-9'-oxo-8',9'-dihydrospiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C23 H29 N O4 |
| Smiles: | CCC(C)NC(c1c(C)c2c3C(CC4(CCCCCC4)Oc3ccc2o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4535 |
| logD: | 4.4535 |
| logSw: | -4.8334 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.205 |
| InChI Key: | QDNDYTYATIRHEF-AWEZNQCLSA-N |