1-{4-[(4-fluorophenyl)acetyl]-1,4-diazepan-1-yl}-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
Chemical Structure Depiction of
1-{4-[(4-fluorophenyl)acetyl]-1,4-diazepan-1-yl}-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
1-{4-[(4-fluorophenyl)acetyl]-1,4-diazepan-1-yl}-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
Compound characteristics
| Compound ID: | V002-9074 |
| Compound Name: | 1-{4-[(4-fluorophenyl)acetyl]-1,4-diazepan-1-yl}-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one |
| Molecular Weight: | 519.68 |
| Molecular Formula: | C30 H34 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C(N1CCCN(CC1)C(Cc1ccc(cc1)F)=O)=O)N1CCc2c(ccs2)C1c1ccccc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1301 |
| logD: | 5.1021 |
| logSw: | -4.8718 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.816 |
| InChI Key: | SZSVCDMMIBRXBM-UHFFFAOYSA-N |