N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
Compound characteristics
| Compound ID: | V022-3090 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide |
| Molecular Weight: | 561.64 |
| Molecular Formula: | C29 H28 F N5 O4 S |
| Smiles: | CC1=C(C(N2C(CC(NCCc3ccc(c(c3)OC)OC)=O)=CSC2=N1)=O)c1cc(C)n(c2ccc(cc2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6599 |
| logD: | 2.6599 |
| logSw: | -3.0554 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.227 |
| InChI Key: | RVRGOJCHBLZEAG-UHFFFAOYSA-N |