1-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one
1-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V018-2085 |
| Compound Name: | 1-{4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]-1,4-diazepan-1-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 479.66 |
| Molecular Formula: | C26 H29 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)C(CN1CCc2c(ccs2)C1c1ccccc1)=O)C(Cc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5686 |
| logD: | 3.5283 |
| logSw: | -3.5554 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.8 |
| InChI Key: | VAGRFOADOQAARJ-AREMUKBSSA-N |