2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4618-0045 |
| Compound Name: | 2-(4-methylpiperazin-1-yl)-3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C20 H21 N5 O2 S2 |
| Smiles: | CN1CCN(CC1)C1=C(/C=C2/C(N(CC=C)C(=S)S2)=O)C(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7258 |
| logD: | 1.3857 |
| logSw: | -2.0971 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 48.962 |
| InChI Key: | IUXSZQFDAHPQDN-UHFFFAOYSA-N |