2'-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Chemical Structure Depiction of
2'-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
2'-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one
Compound characteristics
Compound ID: | E003-0002 |
Compound Name: | 2'-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1'-methylspiro[cyclohexane-1,7'-furo[3,2-f][1]benzopyran]-9'(8'H)-one |
Molecular Weight: | 493 |
Molecular Formula: | C28 H29 Cl N2 O4 |
Smiles: | Cc1c2c3C(CC4(CCCCC4)Oc3ccc2oc1C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.5898 |
logD: | 5.5898 |
logSw: | -6.2351 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.657 |
InChI Key: | PCXQZXPERCBPKB-UHFFFAOYSA-N |