3-[2-(4-chloro-3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide
Chemical Structure Depiction of
3-[2-(4-chloro-3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide
3-[2-(4-chloro-3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide
Compound characteristics
| Compound ID: | 6392-0372 |
| Compound Name: | 3-[2-(4-chloro-3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-{3-[(propan-2-yl)oxy]propyl}prop-2-enamide |
| Molecular Weight: | 480.95 |
| Molecular Formula: | C25 H25 Cl N4 O4 |
| Smiles: | CC(C)OCCCNC(C(=C\C1=C(N=C2C=CC=CN2C1=O)Oc1ccc(c(C)c1)[Cl])\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5214 |
| logD: | 3.5212 |
| logSw: | -3.9349 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.526 |
| InChI Key: | IPSMMBOXHRFDOV-UHFFFAOYSA-N |