ethyl 5-[(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)sulfamoyl]-3-methyl-1-benzofuran-2-carboxylate
Chemical Structure Depiction of
ethyl 5-[(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)sulfamoyl]-3-methyl-1-benzofuran-2-carboxylate
ethyl 5-[(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)sulfamoyl]-3-methyl-1-benzofuran-2-carboxylate
Compound characteristics
| Compound ID: | C301-4390 |
| Compound Name: | ethyl 5-[(7-hydroxy-5-methyl-2-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)sulfamoyl]-3-methyl-1-benzofuran-2-carboxylate |
| Molecular Weight: | 473.51 |
| Molecular Formula: | C21 H23 N5 O6 S |
| Smiles: | CCCc1nc2nc(C)c(c(n2n1)O)NS(c1ccc2c(c1)c(C)c(C(=O)OCC)o2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6395 |
| logD: | 0.8044 |
| logSw: | -2.9084 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.332 |
| InChI Key: | PQHXCEXUEMOTLH-UHFFFAOYSA-N |