ethyl 2-{[(3-bromo-4-methoxyphenyl)methyl]amino}-3-[(2,4-dimethoxyphenyl)carbamoyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(3-bromo-4-methoxyphenyl)methyl]amino}-3-[(2,4-dimethoxyphenyl)carbamoyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
ethyl 2-{[(3-bromo-4-methoxyphenyl)methyl]amino}-3-[(2,4-dimethoxyphenyl)carbamoyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Compound characteristics
| Compound ID: | K801-0793 |
| Compound Name: | ethyl 2-{[(3-bromo-4-methoxyphenyl)methyl]amino}-3-[(2,4-dimethoxyphenyl)carbamoyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate |
| Molecular Weight: | 604.52 |
| Molecular Formula: | C27 H30 Br N3 O6 S |
| Smiles: | CCOC(N1CCc2c(C(Nc3ccc(cc3OC)OC)=O)c(NCc3ccc(c(c3)[Br])OC)sc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1472 |
| logD: | 5.147 |
| logSw: | -5.1713 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.1 |
| InChI Key: | IGTLQSAPFIOHPK-UHFFFAOYSA-N |