2-cyano-3-[9-methyl-2-(3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[9-methyl-2-(3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide
2-cyano-3-[9-methyl-2-(3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide
Compound characteristics
| Compound ID: | 6392-0806 |
| Compound Name: | 2-cyano-3-[9-methyl-2-(3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C26 H28 N4 O4 |
| Smiles: | CC(C)OCCCNC(C(=C\C1=C(N=C2C(C)=CC=CN2C1=O)Oc1cccc(C)c1)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0037 |
| logD: | 3.0035 |
| logSw: | -3.2524 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.547 |
| InChI Key: | DNAFWUGUGKNYJF-UHFFFAOYSA-N |