2'-(4-ethylpiperazine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Chemical Structure Depiction of
2'-(4-ethylpiperazine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
2'-(4-ethylpiperazine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Compound characteristics
| Compound ID: | E003-0972 |
| Compound Name: | 2'-(4-ethylpiperazine-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C25 H32 N2 O4 |
| Smiles: | CCN1CCN(CC1)C(c1c(C)c2c3C(CC4(CCCCCC4)Oc3ccc2o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.897 |
| logD: | 3.7245 |
| logSw: | -4.469 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.264 |
| InChI Key: | DMHJGGVFINBEMY-UHFFFAOYSA-N |