9-methyl-2-{[(oxolan-2-yl)methyl]amino}-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
9-methyl-2-{[(oxolan-2-yl)methyl]amino}-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
9-methyl-2-{[(oxolan-2-yl)methyl]amino}-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4678-0109 |
| Compound Name: | 9-methyl-2-{[(oxolan-2-yl)methyl]amino}-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 402.49 |
| Molecular Formula: | C18 H18 N4 O3 S2 |
| Smiles: | CC1=CC=CN2C1=NC(=C(/C=C1/C(NC(=S)S1)=O)C2=O)NCC1CCCO1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3294 |
| logD: | -4.5616 |
| logSw: | -1.8583 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.318 |
| InChI Key: | HIBPKHHIODYTLR-LLVKDONJSA-N |