2-{1,5-dioxo-4-[(thiophen-2-yl)methyl]-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}-N-(2-fluoro-4-methylphenyl)acetamide
					Chemical Structure Depiction of
2-{1,5-dioxo-4-[(thiophen-2-yl)methyl]-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}-N-(2-fluoro-4-methylphenyl)acetamide
			2-{1,5-dioxo-4-[(thiophen-2-yl)methyl]-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}-N-(2-fluoro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C200-8587 | 
| Compound Name: | 2-{1,5-dioxo-4-[(thiophen-2-yl)methyl]-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}-N-(2-fluoro-4-methylphenyl)acetamide | 
| Molecular Weight: | 469.51 | 
| Molecular Formula: | C21 H16 F N5 O3 S2 | 
| Smiles: | Cc1ccc(c(c1)F)NC(CN1C(N2C(=N1)N(Cc1cccs1)C(c1c2ccs1)=O)=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 3.6263 | 
| logD: | 3.6262 | 
| logSw: | -3.9097 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 72.424 | 
| InChI Key: | MKLMDSNFRYRDJN-UHFFFAOYSA-N | 
 
				 
				