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-(2,4-dichlorophenyl)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-(2,4-dichlorophenyl)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-(2,4-dichlorophenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | V030-6497 |
| 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-(2,4-dichlorophenyl)ethyl]acetamide |
| Molecular Weight: | 600.95 |
| Molecular Formula: | C28 H24 Cl3 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(N2C(CC(NCCc3ccc(cc3[Cl])[Cl])=O)=CSC2=N1)=O)c1cc(C)n(c2cc(ccc2C)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7835 |
| logD: | 5.7835 |
| logSw: | -5.9696 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.665 |
| InChI Key: | FAVQZFUBGFGCRA-UHFFFAOYSA-N |