N-methyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Chemical Structure Depiction of
N-methyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
N-methyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | K416-0148 |
| Compound Name: | N-methyl-1-(pyridin-3-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide |
| Molecular Weight: | 272.37 |
| Molecular Formula: | C14 H16 N4 S |
| Smiles: | [H]N(C)C(N1CCn2cccc2C1c1cccnc1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7834 |
| logD: | 1.7777 |
| logSw: | -1.2888 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.8728 |
| InChI Key: | XZRKOPXZCFGDRV-CYBMUJFWSA-N |