3-({[4-methyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
3-({[4-methyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide
3-({[4-methyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
Compound ID: | V026-8020 |
Compound Name: | 3-({[4-methyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide |
Molecular Weight: | 428.55 |
Molecular Formula: | C22 H28 N4 O3 S |
Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)C(NCC1CCCO1)=O)N1CCOCC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.7186 |
logD: | 2.7183 |
logSw: | -3.0063 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.959 |
InChI Key: | FTARVHPQVYJINA-LJQANCHMSA-N |