ethyl 2-{[2-(2-methylphenyl)quinoline-4-carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[2-(2-methylphenyl)quinoline-4-carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
ethyl 2-{[2-(2-methylphenyl)quinoline-4-carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3366-7210 |
| Compound Name: | ethyl 2-{[2-(2-methylphenyl)quinoline-4-carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate |
| Molecular Weight: | 498.64 |
| Molecular Formula: | C30 H30 N2 O3 S |
| Smiles: | CCOC(c1c2CCCCCCc2sc1NC(c1cc(c2ccccc2C)nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7065 |
| logD: | 5.7672 |
| logSw: | -5.9055 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.188 |
| InChI Key: | IVOWYMVZRGGYSW-UHFFFAOYSA-N |