39D
4-{2-[(1S)-1-({[trans-4-(aminomethyl)cyclohexyl]carbonyl}amino)-2-phenylethyl]-1H-imidazol-4-yl}benzamide
Find entries where: 39D
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 4-{2-[(1S)-1-({[trans-4-(aminomethyl)cyclohexyl]carbonyl}amino)-2-phenylethyl]-1H-imidazol-4-yl}benzamide |
Identifiers | 4-[2-[(1S)-1-[[4-(aminomethyl)cyclohexyl]carbonylamino]-2-phenyl-ethyl]-1H-imidazol-4-yl]benzamide |
Formula | C26 H31 N5 O2 |
Molecular Weight | 445.557 |
Type | NON-POLYMER |
Isomeric SMILES | c1ccc(cc1)C[C@@H](c2[nH]cc(n2)c3ccc(cc3)C(=O)N)NC(=O)C4CCC(CC4)CN |
InChI | InChI=1S/C26H31N5O2/c27-15-18-6-8-21(9-7-18)26(33)31-22(14-17-4-2-1-3-5-17)25-29-16-23(30-25)19-10-12-20(13-11-19)24(28)32/h1-5,10-13,16,18,21-22H,6-9,14-15,27H2,(H2,28,32)(H,29,30)(H,31,33)/t18-,21-,22-/m0/s1 |
InChIKey | UXCQKLRVLBOFGG-NYVOZVTQSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 64 |
Chiral Atom Count | 1 |
Bond Count | 67 |
Aromatic Bond Count | 17 |