{3-[2-(azepan-1-yl)pyridin-4-yl]-1,2,4-oxadiazol-5-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Chemical Structure Depiction of
{3-[2-(azepan-1-yl)pyridin-4-yl]-1,2,4-oxadiazol-5-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
{3-[2-(azepan-1-yl)pyridin-4-yl]-1,2,4-oxadiazol-5-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
Compound characteristics
Compound ID: | P642-0975 |
Compound Name: | {3-[2-(azepan-1-yl)pyridin-4-yl]-1,2,4-oxadiazol-5-yl}(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone |
Molecular Weight: | 413.48 |
Molecular Formula: | C21 H27 N5 O4 |
Smiles: | C1CCCN(CC1)c1cc(ccn1)c1nc(C(N2CCC3(CC2)OCCO3)=O)on1 |
Stereo: | ACHIRAL |
logP: | 3.1136 |
logD: | 3.1072 |
logSw: | -3.1879 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 75.296 |
InChI Key: | WCDDVRUIPDUKIF-UHFFFAOYSA-N |