(2RS)-N-[1-(1H-benzimidazol-2-yl)ethyl]-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanamide
Chemical Structure Depiction of
(2RS)-N-[1-(1H-benzimidazol-2-yl)ethyl]-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanamide
(2RS)-N-[1-(1H-benzimidazol-2-yl)ethyl]-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanamide
Compound characteristics
| Compound ID: | Y043-6118 |
| Compound Name: | (2RS)-N-[1-(1H-benzimidazol-2-yl)ethyl]-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanamide |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C22 H23 N5 O3 S |
| Smiles: | CC(c1nc2ccccc2[nH]1)NC([C@H](CCSC)N1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8723 |
| logD: | 2.8706 |
| logSw: | -3.6253 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.545 |
| InChI Key: | UPJAHDKGGAFCHJ-UWBLVGDVSA-N |