1-(4-{[4-(4-chlorophenyl)-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-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2,2-dimethylpropan-1-one
1-(4-{[4-(4-chlorophenyl)-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: | V022-0443 |
| Compound Name: | 1-(4-{[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)-2,2-dimethylpropan-1-one |
| Molecular Weight: | 474.06 |
| Molecular Formula: | C25 H32 Cl N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)C(N1CCCN(CC1)C(CN1CCc2c(ccs2)C1c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3835 |
| logD: | 4.3719 |
| logSw: | -4.7615 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.581 |
| InChI Key: | GGNWSVKXSLZHLI-HSZRJFAPSA-N |