methyl 4-{[3,5,6-trimethyl-2-(piperidine-1-carbonyl)-1-benzofuran-7-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[3,5,6-trimethyl-2-(piperidine-1-carbonyl)-1-benzofuran-7-sulfonyl]amino}benzoate
methyl 4-{[3,5,6-trimethyl-2-(piperidine-1-carbonyl)-1-benzofuran-7-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | L295-0612 |
| Compound Name: | methyl 4-{[3,5,6-trimethyl-2-(piperidine-1-carbonyl)-1-benzofuran-7-sulfonyl]amino}benzoate |
| Molecular Weight: | 484.57 |
| Molecular Formula: | C25 H28 N2 O6 S |
| Smiles: | Cc1cc2c(C)c(C(N3CCCCC3)=O)oc2c(c1C)S(Nc1ccc(cc1)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0029 |
| logD: | 3.1128 |
| logSw: | -4.6519 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.469 |
| InChI Key: | QSJJKKMMKAOLAC-UHFFFAOYSA-N |