2-{6-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{6-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-{6-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | V004-5567 |
| Compound Name: | 2-{6-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 592.12 |
| Molecular Formula: | C30 H30 Cl N5 O4 S |
| Smiles: | CC1=C(C(N2C(CC(NCCc3ccc(c(c3)OC)OC)=O)=CSC2=N1)=O)c1cc(C)n(c2cc(ccc2C)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7142 |
| logD: | 3.7142 |
| logSw: | -4.1474 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.926 |
| InChI Key: | JYSDUEYCRVTSRQ-UHFFFAOYSA-N |