heptyl 2-methyl-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
heptyl 2-methyl-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate
heptyl 2-methyl-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate
Compound characteristics
Compound ID: | 5591-0415 |
Compound Name: | heptyl 2-methyl-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]-1-benzofuran-3-carboxylate |
Molecular Weight: | 471.62 |
Molecular Formula: | C26 H33 N O5 S |
Smiles: | CCCCCCCOC(c1c2cc(ccc2oc1C)NS(c1c(C)cc(C)cc1C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 7.8174 |
logD: | 7.2348 |
logSw: | -5.7184 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.883 |
InChI Key: | OIXGSOFMIPELLH-UHFFFAOYSA-N |