2-(1H-benzimidazol-2-yl)-3-[2-(2-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[2-(2-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[2-(2-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 6392-1044 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[2-(2-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile |
| Molecular Weight: | 449.47 |
| Molecular Formula: | C26 H19 N5 O3 |
| Smiles: | CC1=CC=CN2C1=NC(=C(/C=C(C#N)/c1nc3ccccc3[nH]1)C2=O)Oc1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.929 |
| logD: | 3.9285 |
| logSw: | -4.4297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.556 |
| InChI Key: | RPKCVDBHCKXICI-UHFFFAOYSA-N |