YW5
2-[(R)-(1H-benzimidazol-2-yl)(3-fluorophenyl)methyl]-6-[4-(1-methylpiperidin-4-yl)phenyl]-2,3-dihydro-1H-isoindol-1-one
Find entries where: YW5
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
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Name | 2-[(R)-(1H-benzimidazol-2-yl)(3-fluorophenyl)methyl]-6-[4-(1-methylpiperidin-4-yl)phenyl]-2,3-dihydro-1H-isoindol-1-one |
Identifiers | 2-[(~{R})-1~{H}-benzimidazol-2-yl-(3-fluorophenyl)methyl]-6-[4-(1-methylpiperidin-4-yl)phenyl]-3~{H}-isoindol-1-one |
Formula | C34 H31 F N4 O |
Molecular Weight | 530.635 |
Type | NON-POLYMER |
Isomeric SMILES | CN1CCC(CC1)c2ccc(cc2)c3ccc4c(c3)C(=O)N(C4)[C@H](c5cccc(c5)F)c6[nH]c7ccccc7n6 |
InChI | InChI=1S/C34H31FN4O/c1-38-17-15-24(16-18-38)22-9-11-23(12-10-22)25-13-14-27-21-39(34(40)29(27)20-25)32(26-5-4-6-28(35)19-26)33-36-30-7-2-3-8-31(30)37-33/h2-14,19-20,24,32H,15-18,21H2,1H3,(H,36,37)/t32-/m1/s1 |
InChIKey | ZMKPSKAUYOLPIA-JGCGQSQUSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 71 |
Chiral Atom Count | 1 |
Bond Count | 77 |
Aromatic Bond Count | 28 |