2'-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Chemical Structure Depiction of
2'-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
2'-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Compound characteristics
| Compound ID: | E003-0020 |
| Compound Name: | 2'-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C27 H27 N O4 |
| Smiles: | Cc1c2c3C(CC4(CCCCC4)Oc3ccc2oc1C(N1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1075 |
| logD: | 5.1075 |
| logSw: | -5.1987 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.058 |
| InChI Key: | ADXQNXZVELDJHM-UHFFFAOYSA-N |