7-methyl-2-(4-methylpiperidin-1-yl)-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-methyl-2-(4-methylpiperidin-1-yl)-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
7-methyl-2-(4-methylpiperidin-1-yl)-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
Compound ID: | 4618-0650 |
Compound Name: | 7-methyl-2-(4-methylpiperidin-1-yl)-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
Molecular Weight: | 400.52 |
Molecular Formula: | C19 H20 N4 O2 S2 |
Smiles: | CC1CCN(CC1)C1=C(/C=C2/C(NC(=S)S2)=O)C(N2C=C(C)C=CC2=N1)=O |
Stereo: | ACHIRAL |
logP: | 1.9163 |
logD: | -2.9747 |
logSw: | -2.6157 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.213 |
InChI Key: | BUROONYXFHUHOP-UHFFFAOYSA-N |