2-[4-(3-chlorophenyl)piperazin-1-yl]-3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[4-(3-chlorophenyl)piperazin-1-yl]-3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
2-[4-(3-chlorophenyl)piperazin-1-yl]-3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0555 |
| Compound Name: | 2-[4-(3-chlorophenyl)piperazin-1-yl]-3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 578.11 |
| Molecular Formula: | C28 H24 Cl N5 O3 S2 |
| Smiles: | CC1C=CC2=NC(=C(/C=C3/C(N(Cc4ccco4)C(=S)S3)=O)C(N2C=1)=O)N1CCN(CC1)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8003 |
| logD: | 4.8003 |
| logSw: | -4.7814 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.764 |
| InChI Key: | LZWZVMGUHPOUIB-UHFFFAOYSA-N |