N-benzyl-3,4-dihydropyrazino[1,2-a]benzimidazole-2(1H)-carbothioamide
Chemical Structure Depiction of
N-benzyl-3,4-dihydropyrazino[1,2-a]benzimidazole-2(1H)-carbothioamide
N-benzyl-3,4-dihydropyrazino[1,2-a]benzimidazole-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | C607-0685 |
| Compound Name: | N-benzyl-3,4-dihydropyrazino[1,2-a]benzimidazole-2(1H)-carbothioamide |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C18 H18 N4 S |
| Smiles: | C(c1ccccc1)NC(N1CCn2c3ccccc3nc2C1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.1347 |
| logD: | 3.126 |
| logSw: | -2.9539 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.4015 |
| InChI Key: | UYFDSVURLQHJSN-UHFFFAOYSA-N |