methyl 5-[(2,5-dimethylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(2,5-dimethylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
methyl 5-[(2,5-dimethylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 5591-3409 |
| Compound Name: | methyl 5-[(2,5-dimethylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C25 H22 N2 O6 S |
| Smiles: | Cc1ccc(C)c(c1)S(N(C(c1ccncc1)=O)c1ccc2c(c1)c(C(=O)OC)c(C)o2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.012 |
| logD: | 4.012 |
| logSw: | -4.1379 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.096 |
| InChI Key: | PSIOUUZVURZRPY-UHFFFAOYSA-N |