KPK
4-({1-[(4-methyl-1-benzothiophen-3-yl)methyl]-1H-benzimidazol-2-yl}sulfanyl)butanoic acid
Find entries where: KPK
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 4-({1-[(4-methyl-1-benzothiophen-3-yl)methyl]-1H-benzimidazol-2-yl}sulfanyl)butanoic acid |
Identifiers | 4-[1-[(4-methyl-1-benzothiophen-3-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid |
Formula | C21 H20 N2 O2 S2 |
Molecular Weight | 396.526 |
Type | NON-POLYMER |
Isomeric SMILES | Cc1cccc2c1c(cs2)Cn3c4ccccc4nc3SCCCC(=O)O |
InChI | InChI=1S/C21H20N2O2S2/c1-14-6-4-9-18-20(14)15(13-27-18)12-23-17-8-3-2-7-16(17)22-21(23)26-11-5-10-19(24)25/h2-4,6-9,13H,5,10-12H2,1H3,(H,24,25) |
InChIKey | YSOMBHFITHOMPW-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 47 |
Chiral Atom Count | 0 |
Bond Count | 50 |
Aromatic Bond Count | 20 |
Related Resource References
Resource Name | Reference |
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Pharos | CHEMBL1807642 |
PubChem | 9800909 |
ChEMBL | CHEMBL1807642 |