N-[rel-(1R,2S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanamide
N-[rel-(1R,2S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Compound characteristics
| Compound ID: | Y043-6168 |
| Compound Name: | N-[rel-(1R,2S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanamide |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C24 H27 N5 O3 |
| Smiles: | CCC(C)[C@@H](c1nc2ccccc2[nH]1)NC(CCCN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1622 |
| logD: | 3.1599 |
| logSw: | -3.7018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.573 |
| InChI Key: | FUDWHBRHYYDKGZ-FXMQYSIJSA-N |