N-{3-[benzyl(butyl)amino]propyl}-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(butyl)amino]propyl}-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide
N-{3-[benzyl(butyl)amino]propyl}-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C885-0522 |
| Compound Name: | N-{3-[benzyl(butyl)amino]propyl}-1-(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-3-carboxamide |
| Molecular Weight: | 496.67 |
| Molecular Formula: | C26 H36 N6 O2 S |
| Smiles: | CCCCN(CCCNC(C1CCCN(C1)C1=NN2C(=NC(C)=CC2=O)S1)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.206 |
| logD: | 1.5869 |
| logSw: | -3.2976 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.099 |
| InChI Key: | WWZIUHGXHAGOJW-QFIPXVFZSA-N |