2-(4-bromobenzene-1-sulfonyl)-3-(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile
Chemical Structure Depiction of
2-(4-bromobenzene-1-sulfonyl)-3-(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile
2-(4-bromobenzene-1-sulfonyl)-3-(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 6392-0027 |
| Compound Name: | 2-(4-bromobenzene-1-sulfonyl)-3-(4-oxo-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile |
| Molecular Weight: | 508.35 |
| Molecular Formula: | C23 H14 Br N3 O4 S |
| Smiles: | C1C=CN2C(C=1)=NC(=C(\C=C(/C#N)S(c1ccc(cc1)[Br])(=O)=O)C2=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1498 |
| logD: | 4.1498 |
| logSw: | -4.4796 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.299 |
| InChI Key: | VYLNRIHEZVJRJR-UHFFFAOYSA-N |