tert-butyl ({3-[1-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl}oxy)acetate
Chemical Structure Depiction of
tert-butyl ({3-[1-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl}oxy)acetate
tert-butyl ({3-[1-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl}oxy)acetate
Compound characteristics
| Compound ID: | V008-0949 |
| Compound Name: | tert-butyl ({3-[1-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl}oxy)acetate |
| Molecular Weight: | 480.95 |
| Molecular Formula: | C25 H25 Cl N4 O4 |
| Smiles: | CC1=C(C(N2C=CC=C(C2=N1)OCC(=O)OC(C)(C)C)=O)c1cc(C)n(c2cccc(c2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0095 |
| logD: | 4.0089 |
| logSw: | -4.4049 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.408 |
| InChI Key: | SYTZGMOZKAQLHH-UHFFFAOYSA-N |