5-amino-4-(1-methyl-1H-benzimidazol-2-yl)-1-{4-[(propan-2-yl)oxy]phenyl}-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1-methyl-1H-benzimidazol-2-yl)-1-{4-[(propan-2-yl)oxy]phenyl}-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1-methyl-1H-benzimidazol-2-yl)-1-{4-[(propan-2-yl)oxy]phenyl}-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D086-0525 |
| Compound Name: | 5-amino-4-(1-methyl-1H-benzimidazol-2-yl)-1-{4-[(propan-2-yl)oxy]phenyl}-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C21 H22 N4 O2 |
| Smiles: | CC(C)Oc1ccc(cc1)N1CC(C(=C1N)c1nc2ccccc2n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2778 |
| logD: | 3.2778 |
| logSw: | -3.5845 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.512 |
| InChI Key: | LWXAQIQFCCOZMZ-UHFFFAOYSA-N |