1-{4-[(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl}-2-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl}-2-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethan-1-one
1-{4-[(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl}-2-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | V025-3322 |
| Compound Name: | 1-{4-[(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl}-2-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethan-1-one |
| Molecular Weight: | 503.66 |
| Molecular Formula: | C29 H33 N3 O3 S |
| Salt: | not_available |
| Smiles: | COc1ccc(CC(N2CCCN(CC2)C(CN2CCc3c(ccs3)C2c2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9997 |
| logD: | 3.9595 |
| logSw: | -4.1113 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.326 |
| InChI Key: | NZDRAIPRQPYARO-GDLZYMKVSA-N |