2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]ethan-1-one
2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V006-0805 |
| Compound Name: | 2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(2-methylbenzoyl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 508.08 |
| Molecular Formula: | C28 H30 Cl N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C(N1CCCN(CC1)C(CN1CCc2c(ccs2)C1c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.719 |
| logD: | 4.7074 |
| logSw: | -5.0248 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.309 |
| InChI Key: | KWCIQFRBYBICMW-HHHXNRCGSA-N |