2,2-dimethyl-1-(4-{[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)propan-1-one
Chemical Structure Depiction of
2,2-dimethyl-1-(4-{[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)propan-1-one
2,2-dimethyl-1-(4-{[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)propan-1-one
Compound characteristics
| Compound ID: | V022-4731 |
| Compound Name: | 2,2-dimethyl-1-(4-{[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-1,4-diazepan-1-yl)propan-1-one |
| Molecular Weight: | 453.65 |
| Molecular Formula: | C26 H35 N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C1c2ccsc2CCN1CC(N1CCCN(CC1)C(C(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2196 |
| logD: | 4.1947 |
| logSw: | -4.0721 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.581 |
| InChI Key: | NMGLOCWAKWBJBV-XMMPIXPASA-N |