N-(3-acetylphenyl)-2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
N-(3-acetylphenyl)-2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | D458-0522 |
| Compound Name: | N-(3-acetylphenyl)-2-[5,7-dimethyl-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 405.48 |
| Molecular Formula: | C21 H19 N5 O2 S |
| Smiles: | CC(c1cccc(c1)NC(Cc1c(C)nc2nc(c3cccs3)nn2c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0763 |
| logD: | 3.0755 |
| logSw: | -3.3305 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.827 |
| InChI Key: | HKWNJGPVLDVRCO-UHFFFAOYSA-N |