methyl 6-tert-butyl-2-{[2-(thiophen-2-yl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 6-tert-butyl-2-{[2-(thiophen-2-yl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 6-tert-butyl-2-{[2-(thiophen-2-yl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-5480 |
| Compound Name: | methyl 6-tert-butyl-2-{[2-(thiophen-2-yl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 504.67 |
| Molecular Formula: | C28 H28 N2 O3 S2 |
| Smiles: | CC(C)(C)C1CCc2c(C(=O)OC)c(NC(c3cc(c4cccs4)nc4ccccc34)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4932 |
| logD: | 5.531 |
| logSw: | -5.9628 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.296 |
| InChI Key: | KTGGZFVKWHLXTI-MRXNPFEDSA-N |