2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[3-(morpholin-4-yl)propyl]acetamide
Chemical Structure Depiction of
2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[3-(morpholin-4-yl)propyl]acetamide
2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[3-(morpholin-4-yl)propyl]acetamide
Compound characteristics
| Compound ID: | V022-0193 |
| Compound Name: | 2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-[3-(morpholin-4-yl)propyl]acetamide |
| Molecular Weight: | 534.68 |
| Molecular Formula: | C28 H34 N6 O3 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(N2C(CC(NCCCN3CCOCC3)=O)=CSC2=N1)=O)c1cc(C)n(c2cc(C)ccc2C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3344 |
| logD: | 1.9109 |
| logSw: | -2.6783 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.556 |
| InChI Key: | XNNWHCUZFQSAOW-UHFFFAOYSA-N |