1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-phenoxyethan-1-one
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | V025-3324 |
| Compound Name: | 1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2-phenoxyethan-1-one |
| Molecular Weight: | 507.63 |
| Molecular Formula: | C28 H30 F N3 O3 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)C(COc1ccccc1)=O)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5724 |
| logD: | 3.5499 |
| logSw: | -3.7844 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.281 |
| InChI Key: | KGNDGLODVQXWFH-MUUNZHRXSA-N |