2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
Compound ID: | 4618-0233 |
Compound Name: | 2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
Molecular Weight: | 491.63 |
Molecular Formula: | C25 H25 N5 O2 S2 |
Smiles: | CC(c1ccccc1)N1C(/C(=C/C2=C(N=C3C=CC=CN3C2=O)N2CCN(C)CC2)SC1=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0596 |
logD: | 2.7196 |
logSw: | -3.2075 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 48.053 |
InChI Key: | VQSOHBCOFWHKJD-KRWDZBQOSA-N |