4-[(5,8-dioxotetrahydro-3H-[1,3]thiazolo[3,4-a]pyrazin-7(1H)-yl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}benzamide
Chemical Structure Depiction of
4-[(5,8-dioxotetrahydro-3H-[1,3]thiazolo[3,4-a]pyrazin-7(1H)-yl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}benzamide
4-[(5,8-dioxotetrahydro-3H-[1,3]thiazolo[3,4-a]pyrazin-7(1H)-yl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}benzamide
Compound characteristics
| Compound ID: | E757-0213 |
| Compound Name: | 4-[(5,8-dioxotetrahydro-3H-[1,3]thiazolo[3,4-a]pyrazin-7(1H)-yl)methyl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}benzamide |
| Molecular Weight: | 455.6 |
| Molecular Formula: | C23 H25 N3 O3 S2 |
| Smiles: | CSc1ccc(CCNC(c2ccc(CN3CC(N4CSCC4C3=O)=O)cc2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.075 |
| logD: | 2.075 |
| logSw: | -2.7455 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.912 |
| InChI Key: | ZETKKVKLKMZUPX-HXUWFJFHSA-N |