7-methyl-3-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-methyl-3-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
7-methyl-3-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0856 |
| Compound Name: | 7-methyl-3-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C24 H21 N3 O3 S3 |
| Smiles: | CC1C=CC2=NC(=C(/C=C3/C(N(CC4CCCO4)C(=S)S3)=O)C(N2C=1)=O)Sc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.868 |
| logD: | 3.868 |
| logSw: | -4.0097 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 49.933 |
| InChI Key: | WCMWSUOCBJFKEN-MRXNPFEDSA-N |