3,3-dimethyl-1-{2-methyl-4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
3,3-dimethyl-1-{2-methyl-4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]piperazin-1-yl}butan-1-one
3,3-dimethyl-1-{2-methyl-4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V022-8879 |
| Compound Name: | 3,3-dimethyl-1-{2-methyl-4-[(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetyl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 453.65 |
| Molecular Formula: | C26 H35 N3 O2 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(CC(C)(C)C)=O)C(CN1CCc2c(ccs2)C1c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4434 |
| logD: | 4.4032 |
| logSw: | -4.2407 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.941 |
| InChI Key: | XXPALVIIUXDTOZ-UHFFFAOYSA-N |