1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2,2-dimethylpropan-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)-2,2-dimethylpropan-1-one
1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2,2-dimethylpropan-1-one
Compound characteristics
| Compound ID: | V023-5703 |
| Compound Name: | 1-(4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2,2-dimethylpropan-1-one |
| Molecular Weight: | 457.61 |
| Molecular Formula: | C25 H32 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)C(N1CCCN(CC1)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8748 |
| logD: | 3.8523 |
| logSw: | -3.8851 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.581 |
| InChI Key: | IXQGUWSORQYOIZ-HSZRJFAPSA-N |