N-(2,3-dimethylcyclohexyl)-3-methyl-5-(pyrrolidine-1-sulfonyl)-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-(2,3-dimethylcyclohexyl)-3-methyl-5-(pyrrolidine-1-sulfonyl)-1-benzofuran-2-carboxamide
N-(2,3-dimethylcyclohexyl)-3-methyl-5-(pyrrolidine-1-sulfonyl)-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | C153-0689 |
| Compound Name: | N-(2,3-dimethylcyclohexyl)-3-methyl-5-(pyrrolidine-1-sulfonyl)-1-benzofuran-2-carboxamide |
| Molecular Weight: | 418.55 |
| Molecular Formula: | C22 H30 N2 O4 S |
| Smiles: | CC1CCCC(C1C)NC(c1c(C)c2cc(ccc2o1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1414 |
| logD: | 4.1414 |
| logSw: | -4.1092 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.37 |
| InChI Key: | PYOQMXCODHVKSE-UHFFFAOYSA-N |