2-(4-benzylpiperazin-1-yl)-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-4H-pyrido[1,2-a]pyrimidin-4-one
2-(4-benzylpiperazin-1-yl)-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0934 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 567.73 |
| Molecular Formula: | C31 H29 N5 O2 S2 |
| Smiles: | Cc1ccc(CN2C(/C(=C/C3=C(N=C4C=CC=CN4C3=O)N3CCN(CC3)Cc3ccccc3)SC2=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7635 |
| logD: | 4.7134 |
| logSw: | -4.4215 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 48.776 |
| InChI Key: | ROZPPLVEXCXUTR-UHFFFAOYSA-N |