3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-[(2-methoxyethyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-[(2-methoxyethyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-[(2-methoxyethyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
Compound ID: | 4428-0499 |
Compound Name: | 3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-[(2-methoxyethyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
Molecular Weight: | 456.54 |
Molecular Formula: | C21 H20 N4 O4 S2 |
Smiles: | CC1=CC=CN2C1=NC(=C(/C=C1/C(N(Cc3ccco3)C(=S)S1)=O)C2=O)NCCOC |
Stereo: | ACHIRAL |
logP: | 2.2281 |
logD: | 2.2278 |
logSw: | -2.6809 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.41 |
InChI Key: | RPIPYQIKPPUSBN-UHFFFAOYSA-N |