ethyl 3-[(5-chloro-2-methoxyphenyl)carbamoyl]-2-({[4-(dimethylamino)phenyl]methyl}amino)-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Chemical Structure Depiction of
ethyl 3-[(5-chloro-2-methoxyphenyl)carbamoyl]-2-({[4-(dimethylamino)phenyl]methyl}amino)-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
ethyl 3-[(5-chloro-2-methoxyphenyl)carbamoyl]-2-({[4-(dimethylamino)phenyl]methyl}amino)-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Compound characteristics
| Compound ID: | K801-0971 |
| Compound Name: | ethyl 3-[(5-chloro-2-methoxyphenyl)carbamoyl]-2-({[4-(dimethylamino)phenyl]methyl}amino)-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate |
| Molecular Weight: | 543.08 |
| Molecular Formula: | C27 H31 Cl N4 O4 S |
| Smiles: | CCOC(N1CCc2c(C(Nc3cc(ccc3OC)[Cl])=O)c(NCc3ccc(cc3)N(C)C)sc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2171 |
| logD: | 5.1918 |
| logSw: | -5.8635 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.73 |
| InChI Key: | SQCRIQGJNGCVJR-UHFFFAOYSA-N |