2-[4-(azepane-1-carbonyl)piperidin-1-yl]-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C885-4797 |
| Compound Name: | 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 403.55 |
| Molecular Formula: | C20 H29 N5 O2 S |
| Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N1CCC(CC1)C(N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1484 |
| logD: | 3.1451 |
| logSw: | -3.0148 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.557 |
| InChI Key: | DOWOAOASUXOFLC-UHFFFAOYSA-N |