2-(4-benzylpiperidin-1-yl)-9-methyl-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-benzylpiperidin-1-yl)-9-methyl-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
2-(4-benzylpiperidin-1-yl)-9-methyl-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0302 |
| Compound Name: | 2-(4-benzylpiperidin-1-yl)-9-methyl-3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Smiles: | CC1=CC=CN2C1=NC(=C(/C=C1/C(NC(=S)S1)=O)C2=O)N1CCC(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5229 |
| logD: | -1.368 |
| logSw: | -3.8104 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.443 |
| InChI Key: | QLKJJFXQWAXTKV-UHFFFAOYSA-N |