methyl 5-[(4-tert-butylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(4-tert-butylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
methyl 5-[(4-tert-butylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 5591-1597 |
| Compound Name: | methyl 5-[(4-tert-butylbenzene-1-sulfonyl)(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 506.58 |
| Molecular Formula: | C27 H26 N2 O6 S |
| Smiles: | Cc1c(C(=O)OC)c2cc(ccc2o1)N(C(c1ccncc1)=O)S(c1ccc(cc1)C(C)(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0202 |
| logD: | 5.0202 |
| logSw: | -4.8577 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.096 |
| InChI Key: | JHXIXCNADOOOAI-UHFFFAOYSA-N |