(1,4-dioxa-8-azaspiro[4.5]decan-8-yl){4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl}methanone
Chemical Structure Depiction of
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl){4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl}methanone
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl){4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl}methanone
Compound characteristics
Compound ID: | C797-1075 |
Compound Name: | (1,4-dioxa-8-azaspiro[4.5]decan-8-yl){4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl}methanone |
Molecular Weight: | 514.65 |
Molecular Formula: | C29 H30 N4 O3 S |
Smiles: | Cc1cccc(CSc2nc3ccncc3n2Cc2ccc(cc2)C(N2CCC3(CC2)OCCO3)=O)c1 |
Stereo: | ACHIRAL |
logP: | 4.4625 |
logD: | 4.4594 |
logSw: | -4.1663 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.08 |
InChI Key: | XUVWSHHGNXNUFD-UHFFFAOYSA-N |