ethyl 6-ethyl-2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-ethyl-2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-ethyl-2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 7213-0482 |
| Compound Name: | ethyl 6-ethyl-2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C19 H21 N5 O3 S |
| Smiles: | CCC1CCc2c(C(=O)OCC)c(NC(c3nc4ncccn4n3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9107 |
| logD: | -0.6771 |
| logSw: | -3.296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.416 |
| InChI Key: | OKHUGMUIFLYRDM-LLVKDONJSA-N |