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-[(pyridin-4-yl)methyl]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-[(pyridin-4-yl)methyl]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-[(pyridin-4-yl)methyl]acetamide
Compound characteristics
| Compound ID: | V022-2172 |
| 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-[(pyridin-4-yl)methyl]acetamide |
| Molecular Weight: | 519.02 |
| Molecular Formula: | C26 H23 Cl N6 O2 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(N2C(CC(NCc3ccncc3)=O)=CSC2=N1)=O)c1cc(C)n(c2cc(ccc2C)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0659 |
| logD: | 3.0625 |
| logSw: | -3.46 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.252 |
| InChI Key: | ODOSHYXOFRTNPR-UHFFFAOYSA-N |