1-(4-benzoyl-1,4-diazepan-1-yl)-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Chemical Structure Depiction of
1-(4-benzoyl-1,4-diazepan-1-yl)-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
1-(4-benzoyl-1,4-diazepan-1-yl)-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | V028-8648 |
| Compound Name: | 1-(4-benzoyl-1,4-diazepan-1-yl)-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one |
| Molecular Weight: | 494.06 |
| Molecular Formula: | C27 H28 Cl N3 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)C(c1ccccc1)=O)C(CN1CCc2c(ccs2)C1c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2234 |
| logD: | 4.2117 |
| logSw: | -4.8513 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.309 |
| InChI Key: | IUYICIWQCWNPII-AREMUKBSSA-N |