N-(2-{[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]amino}-2-oxoethyl)pyrazine-2-carboxamide
Chemical Structure Depiction of
N-(2-{[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]amino}-2-oxoethyl)pyrazine-2-carboxamide
N-(2-{[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]amino}-2-oxoethyl)pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | Y042-7258 |
| Compound Name: | N-(2-{[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]amino}-2-oxoethyl)pyrazine-2-carboxamide |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C18 H20 N6 O2 S |
| Smiles: | CSCC[C@@H](c1nc2ccccc2[nH]1)NC(CNC(c1cnccn1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.3257 |
| logD: | 1.322 |
| logSw: | -1.7579 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.61 |
| InChI Key: | GTDRZPKEQZGOFR-AWEZNQCLSA-N |