(azepan-1-yl)(9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-yl)methanone
(azepan-1-yl)(9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-yl)methanone
Compound characteristics
| Compound ID: | C798-0469 |
| Compound Name: | (azepan-1-yl)(9'-hydroxy-1'-methyl-8',9'-dihydrospiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-2'-yl)methanone |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C24 H31 N O4 |
| Smiles: | Cc1c2c3C(CC4(CCCCC4)Oc3ccc2oc1C(N1CCCCCC1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7336 |
| logD: | 4.7336 |
| logSw: | -4.5234 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.095 |
| InChI Key: | IUHVAZCPMKMTAE-KRWDZBQOSA-N |