2-[3-(azepane-1-carbonyl)piperidin-1-yl]-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-[3-(azepane-1-carbonyl)piperidin-1-yl]-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-[3-(azepane-1-carbonyl)piperidin-1-yl]-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C885-0294 |
| Compound Name: | 2-[3-(azepane-1-carbonyl)piperidin-1-yl]-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C18 H25 N5 O2 S |
| Smiles: | CC1=CC(N2C(=N1)SC(=N2)N1CCCC(C1)C(N1CCCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.008 |
| logD: | 2.0029 |
| logSw: | -2.0667 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.884 |
| InChI Key: | MZHYSZMDXZWMLX-AWEZNQCLSA-N |