methyl 5-(diethylcarbamoyl)-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-(diethylcarbamoyl)-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate
methyl 5-(diethylcarbamoyl)-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0665 |
| Compound Name: | methyl 5-(diethylcarbamoyl)-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 515.63 |
| Molecular Formula: | C29 H29 N3 O4 S |
| Smiles: | CCN(CC)C(c1c(C)c(C(=O)OC)c(NC(c2cc(c3ccc(C)cc3)nc3ccccc23)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.86 |
| logD: | 4.4986 |
| logSw: | -5.6974 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.289 |
| InChI Key: | QWHJRURXALWLHR-UHFFFAOYSA-N |