2-(1,3-benzothiazol-2-yl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
2-(1,3-benzothiazol-2-yl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-1860 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile |
| Molecular Weight: | 427.53 |
| Molecular Formula: | C24 H21 N5 O S |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)c1nc3ccccc3s1)C2=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2967 |
| logD: | 4.2967 |
| logSw: | -4.2866 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.558 |
| InChI Key: | RHWOKQHQEQZJBH-UHFFFAOYSA-N |