N-[2-(azepan-1-yl)ethyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C885-4740 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C22 H34 N6 O2 S |
| Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N1CCC(CC1)C(NCCN1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6546 |
| logD: | 0.8719 |
| logSw: | -2.8657 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.146 |
| InChI Key: | FMTVKKZJJHGMIJ-UHFFFAOYSA-N |