5-amino-4-(1H-benzimidazol-2-yl)-1-[(oxan-4-yl)methyl]-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1H-benzimidazol-2-yl)-1-[(oxan-4-yl)methyl]-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1H-benzimidazol-2-yl)-1-[(oxan-4-yl)methyl]-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
Compound ID: | Y043-8828 |
Compound Name: | 5-amino-4-(1H-benzimidazol-2-yl)-1-[(oxan-4-yl)methyl]-1,2-dihydro-3H-pyrrol-3-one |
Molecular Weight: | 312.37 |
Molecular Formula: | C17 H20 N4 O2 |
Smiles: | C1COCCC1CN1CC(C(=C1N)c1nc2ccccc2[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 1.5982 |
logD: | 1.5981 |
logSw: | -2.2009 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 64.537 |
InChI Key: | MSLPUYLFKBGCMS-UHFFFAOYSA-N |