2-(benzylamino)-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(benzylamino)-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-(benzylamino)-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4428-0114 |
| Compound Name: | 2-(benzylamino)-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C27 H22 N4 O2 S2 |
| Smiles: | C(CN1C(/C(=C/C2=C(NCc3ccccc3)N=C3C=CC=CN3C2=O)SC1=S)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0796 |
| logD: | 4.0771 |
| logSw: | -4.2943 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.164 |
| InChI Key: | ASSLOZRUXVSSMR-UHFFFAOYSA-N |