N-[3-(butylsulfanyl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
N-[3-(butylsulfanyl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C885-4768 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 451.65 |
| Molecular Formula: | C21 H33 N5 O2 S2 |
| Smiles: | CCCCSCCCNC(C1CCN(CC1)C1=NN2C(=NC(CCC)=CC2=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4452 |
| logD: | 3.442 |
| logSw: | -3.4869 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.104 |
| InChI Key: | ZQMANYUXDADMPZ-UHFFFAOYSA-N |