2-(1H-benzimidazol-2-yl)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-2173 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C24 H23 N7 O |
| Smiles: | CC1=CC=CN2C1=NC(=C(/C=C(C#N)/c1nc3ccccc3[nH]1)C2=O)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.2198 |
| logD: | 1.8797 |
| logSw: | -2.4787 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.605 |
| InChI Key: | SKFVXMVRDXECNG-UHFFFAOYSA-N |