N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y500-1080 |
| Compound Name: | N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide |
| Molecular Weight: | 497.66 |
| Molecular Formula: | C30 H31 N3 O2 S |
| Smiles: | Cc1ccc(cc1)c1cc(C(Nc2c(C(N)=O)c3CCC(Cc3s2)C(C)(C)C)=O)c2ccccc2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5095 |
| logD: | 6.2714 |
| logSw: | -5.8722 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.163 |
| InChI Key: | NOKBRIFSVAVABL-LJQANCHMSA-N |