methyl 5-[(4-bromobenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(4-bromobenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
methyl 5-[(4-bromobenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 3461-3098 |
| Compound Name: | methyl 5-[(4-bromobenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 529.36 |
| Molecular Formula: | C23 H17 Br N2 O6 S |
| Smiles: | Cc1c(C(=O)OC)c2cc(ccc2o1)N(C(c1ccncc1)=O)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0596 |
| logD: | 4.0596 |
| logSw: | -4.2769 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.096 |
| InChI Key: | WDBRRALHYKEUMH-UHFFFAOYSA-N |