2'-(azepane-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Chemical Structure Depiction of
2'-(azepane-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
2'-(azepane-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Compound characteristics
| Compound ID: | E003-0943 |
| Compound Name: | 2'-(azepane-1-carbonyl)-1'-methylspiro[cycloheptane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C25 H31 N O4 |
| Smiles: | Cc1c2c3C(CC4(CCCCCC4)Oc3ccc2oc1C(N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2301 |
| logD: | 5.2301 |
| logSw: | -5.2888 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.058 |
| InChI Key: | CCPOURVTHLGUPL-UHFFFAOYSA-N |