N-tert-butyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Chemical Structure Depiction of
N-tert-butyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
N-tert-butyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | K416-0151 |
| Compound Name: | N-tert-butyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide |
| Molecular Weight: | 314.45 |
| Molecular Formula: | C17 H22 N4 S |
| Smiles: | [H]N(C(N1CCn2cccc2C1c1cccnc1)=S)C(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2308 |
| logD: | 3.2251 |
| logSw: | -2.9884 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.5462 |
| InChI Key: | LCUSVCYASSNLAG-OAHLLOKOSA-N |