N-[2-(3,4-diethoxyphenyl)ethyl]-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C885-0493 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C24 H31 N5 O4 S |
| Smiles: | CCOc1ccc(CCNC(C2CCCN(C2)C2=NN3C(=NC(C)=CC3=O)S2)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8348 |
| logD: | 1.8298 |
| logSw: | -2.5039 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.58 |
| InChI Key: | FDOHUPCTFAKSOY-SFHVURJKSA-N |