N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{7-methyl-6-[5-methyl-1-(2-methylphenyl)-1H-pyrazol-3-yl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{7-methyl-6-[5-methyl-1-(2-methylphenyl)-1H-pyrazol-3-yl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{7-methyl-6-[5-methyl-1-(2-methylphenyl)-1H-pyrazol-3-yl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
Compound characteristics
| Compound ID: | V008-0884 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{7-methyl-6-[5-methyl-1-(2-methylphenyl)-1H-pyrazol-3-yl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide |
| Molecular Weight: | 557.67 |
| Molecular Formula: | C30 H31 N5 O4 S |
| Smiles: | CC1=C(C(N2C(CC(NCCc3ccc(c(c3)OC)OC)=O)=CSC2=N1)=O)c1cc(C)n(c2ccccc2C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0156 |
| logD: | 3.0156 |
| logSw: | -3.343 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.926 |
| InChI Key: | ALFRRXQAEWPASG-UHFFFAOYSA-N |