ethyl 4-({6-[1-(3,4-dichlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({6-[1-(3,4-dichlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperazine-1-carboxylate
ethyl 4-({6-[1-(3,4-dichlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | V004-5529 |
| Compound Name: | ethyl 4-({6-[1-(3,4-dichlorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperazine-1-carboxylate |
| Molecular Weight: | 589.5 |
| Molecular Formula: | C26 H26 Cl2 N6 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(CC1=CSC2=NC(C)=C(C(N12)=O)c1cc(C)n(c2ccc(c(c2)[Cl])[Cl])n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8741 |
| logD: | 3.8741 |
| logSw: | -4.1166 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.825 |
| InChI Key: | RZHHOWQPXOKUNU-UHFFFAOYSA-N |