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N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]decan-4-yl}cyclohexane-1-carboxamide

N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]decan-4-yl}cyclohexane-1-carboxamide

Formula: C23H24ClF3N2O3

SMILES: FC(F)(F)C1=CC=C(Cl)C(NC(=O)C2CCC(CC2)N2C(=O)C3C4CCC(C4)C3C2=O)=C1

IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]decan-4-yl}cyclohexane-1-carboxamide

InChI: InChI=1/C23H24ClF3N2O3/c24-16-8-5-14(23(25,26)27)10-17(16)28-20(30)11-3-6-15(7-4-11)29-21(31)18-12-1-2-13(9-12)19(18)22(29)32/h5,8,10-13,15,18-19H,1-4,6-7,9H2,(H,28,30)

Composition: C (58.91%), H (5.16%), Cl (7.56%), F (12.16%), N (5.97%), O (10.24%)

Molar Mass: 468.9

Atom Count: 56

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 4
Exact Mass 468.1427548
Formal Charge 0
FSP3 0.61
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LVWVFTBNTRKKTK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 112.73
Topological Polar Surface Area 66.48
Polarizability 42.46
Ring Count 5
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H24ClF3N2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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