N-(4-{[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]amino}-4-oxobutyl)pyrazine-2-carboxamide
Chemical Structure Depiction of
N-(4-{[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]amino}-4-oxobutyl)pyrazine-2-carboxamide
N-(4-{[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]amino}-4-oxobutyl)pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | Y042-7604 |
| Compound Name: | N-(4-{[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]amino}-4-oxobutyl)pyrazine-2-carboxamide |
| Molecular Weight: | 394.48 |
| Molecular Formula: | C21 H26 N6 O2 |
| Smiles: | CC(C)C[C@@H](c1nc2ccccc2[nH]1)NC(CCCNC(c1cnccn1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.454 |
| logD: | 1.4523 |
| logSw: | -1.483 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.452 |
| InChI Key: | SHTDKJSHIDODME-KRWDZBQOSA-N |