5-amino-4-(1H-benzimidazol-2-yl)-1-(2,5-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1H-benzimidazol-2-yl)-1-(2,5-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1H-benzimidazol-2-yl)-1-(2,5-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D086-0058 |
| Compound Name: | 5-amino-4-(1H-benzimidazol-2-yl)-1-(2,5-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 350.38 |
| Molecular Formula: | C19 H18 N4 O3 |
| Smiles: | COc1ccc(c(c1)N1CC(C(=C1N)c1nc2ccccc2[nH]1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5789 |
| logD: | 2.5788 |
| logSw: | -3.0338 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.864 |
| InChI Key: | UZCYSGPWCUGFGO-UHFFFAOYSA-N |