14D
5-methyl-1-[(3S)-1-{3-[3-(trifluoromethyl)phenoxy]benzyl}piperidin-3-yl]pyrimidine-2,4(1H,3H)-dione
Find entries where: 14D
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 5-methyl-1-[(3S)-1-{3-[3-(trifluoromethyl)phenoxy]benzyl}piperidin-3-yl]pyrimidine-2,4(1H,3H)-dione |
Identifiers | 5-methyl-1-[(3S)-1-[[3-[3-(trifluoromethyl)phenoxy]phenyl]methyl]piperidin-3-yl]pyrimidine-2,4-dione |
Formula | C24 H24 F3 N3 O3 |
Molecular Weight | 459.461 |
Type | NON-POLYMER |
Isomeric SMILES | CC1=CN(C(=O)NC1=O)[C@H]2CCCN(C2)Cc3cccc(c3)Oc4cccc(c4)C(F)(F)F |
InChI | InChI=1S/C24H24F3N3O3/c1-16-13-30(23(32)28-22(16)31)19-7-4-10-29(15-19)14-17-5-2-8-20(11-17)33-21-9-3-6-18(12-21)24(25,26)27/h2-3,5-6,8-9,11-13,19H,4,7,10,14-15H2,1H3,(H,28,31,32)/t19-/m0/s1 |
InChIKey | OVDFDRSJZJQKLN-IBGZPJMESA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 57 |
Chiral Atom Count | 1 |
Bond Count | 60 |
Aromatic Bond Count | 12 |
Related Resource References
Resource Name | Reference |
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PubChem | 66545765 |