8-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methoxybenzoyl)-N-[(pyridin-3-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
8-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methoxybenzoyl)-N-[(pyridin-3-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
8-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methoxybenzoyl)-N-[(pyridin-3-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
Compound ID: | V029-3702 |
Compound Name: | 8-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methoxybenzoyl)-N-[(pyridin-3-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide |
Molecular Weight: | 558.59 |
Molecular Formula: | C30 H30 N4 O7 |
Salt: | not_available |
Smiles: | COc1ccc(cc1)C(N1C(COC12CCN(CC2)C(c1ccc2c(c1)OCO2)=O)C(NCc1cccnc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.3278 |
logD: | 1.3254 |
logSw: | -1.3535 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 98.172 |
InChI Key: | AZYDQYUOJMBLMD-XMMPIXPASA-N |