methyl 2-methyl-5-[N-(2,4,5-trimethylbenzene-1-sulfonyl)butanamido]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-[N-(2,4,5-trimethylbenzene-1-sulfonyl)butanamido]-1-benzofuran-3-carboxylate
methyl 2-methyl-5-[N-(2,4,5-trimethylbenzene-1-sulfonyl)butanamido]-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 5591-3385 |
| Compound Name: | methyl 2-methyl-5-[N-(2,4,5-trimethylbenzene-1-sulfonyl)butanamido]-1-benzofuran-3-carboxylate |
| Molecular Weight: | 457.54 |
| Molecular Formula: | C24 H27 N O6 S |
| Smiles: | CCCC(N(c1ccc2c(c1)c(C(=O)OC)c(C)o2)S(c1cc(C)c(C)cc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4729 |
| logD: | 5.4729 |
| logSw: | -5.5817 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.412 |
| InChI Key: | UKKZQIUBNBELNB-UHFFFAOYSA-N |