2-(1,3-benzothiazol-2-yl)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
2-(1,3-benzothiazol-2-yl)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 6392-0671 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile |
| Molecular Weight: | 515.39 |
| Molecular Formula: | C25 H15 Br N4 O2 S |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)c1nc3ccccc3s1)C2=O)Oc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.6962 |
| logD: | 5.6962 |
| logSw: | -5.5614 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.268 |
| InChI Key: | FUTMOBPHBYHXBD-UHFFFAOYSA-N |