5-amino-4-(1H-benzimidazol-2-yl)-1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1H-benzimidazol-2-yl)-1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1H-benzimidazol-2-yl)-1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D487-0501 |
| Compound Name: | 5-amino-4-(1H-benzimidazol-2-yl)-1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C22 H24 N6 O |
| Smiles: | CN1CCN(CC1)c1ccc(cc1)N1CC(C(=C1N)c1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1214 |
| logD: | 1.5533 |
| logSw: | -2.7079 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.919 |
| InChI Key: | YYPFWPITSYSLTB-UHFFFAOYSA-N |