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(2E)-2-cyano-N-cyclohexyl-3-{4-[(3-fluorophenyl)methoxy]phenyl}prop-2-enamide

(2E)-2-cyano-N-cyclohexyl-3-{4-[(3-fluorophenyl)methoxy]phenyl}prop-2-enamide

Formula: C23H23FN2O2

SMILES: FC1=CC(COC2=CC=C(C=C(/C#N)C(=O)NC3CCCCC3)C=C2)=CC=C1

IUPAC: (2E)-2-cyano-N-cyclohexyl-3-{4-[(3-fluorophenyl)methoxy]phenyl}prop-2-enamide

InChI: InChI=1S/C23H23FN2O2/c24-20-6-4-5-18(14-20)16-28-22-11-9-17(10-12-22)13-19(15-25)23(27)26-21-7-2-1-3-8-21/h4-6,9-14,21H,1-3,7-8,16H2,(H,26,27)/b19-13+

Composition: C (73.00%), H (6.13%), F (5.02%), N (7.40%), O (8.46%)

Molar Mass: 378.447

Atom Count: 51

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 378.174356152
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey GLOOVHOERRLVIG-CPNJWEJPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 107.14
Topological Polar Surface Area 62.12
Polarizability 40.58
Ring Count 3
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H23FN2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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