ethyl 4-oxo-4-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}butanoate
Chemical Structure Depiction of
ethyl 4-oxo-4-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}butanoate
ethyl 4-oxo-4-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}butanoate
Compound characteristics
| Compound ID: | V002-9030 |
| Compound Name: | ethyl 4-oxo-4-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}butanoate |
| Molecular Weight: | 483.63 |
| Molecular Formula: | C26 H33 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(CCC(N1CCCN(CC1)C(CN1CCc2c(ccs2)C1c1ccccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7368 |
| logD: | 2.6965 |
| logSw: | -2.8467 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.212 |
| InChI Key: | FWJDWYKGDALWIM-AREMUKBSSA-N |