1'-methyl-N-(3-methylbutyl)-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Chemical Structure Depiction of
1'-methyl-N-(3-methylbutyl)-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
1'-methyl-N-(3-methylbutyl)-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide
Compound characteristics
| Compound ID: | E003-0130 |
| Compound Name: | 1'-methyl-N-(3-methylbutyl)-9'-oxo-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C23 H29 N O4 |
| Smiles: | CC(C)CCNC(c1c(C)c2c3C(CC4(CCCCC4)Oc3ccc2o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6779 |
| logD: | 4.6778 |
| logSw: | -4.7526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.274 |
| InChI Key: | LTLJBYUSHHXBSN-UHFFFAOYSA-N |