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4-{3-[2-(4-chlorophenyl)-2-oxoethoxy]phenyl}-8-methyl-4-azatricyclo[5.2.1.0²,?]dec-8-ene-3,5-dione

4-{3-[2-(4-chlorophenyl)-2-oxoethoxy]phenyl}-8-methyl-4-azatricyclo[5.2.1.0²,?]dec-8-ene-3,5-dione

Formula: C24H20ClNO4

SMILES: CC1=CC2CC1C1C2C(=O)N(C1=O)C1=CC(OCC(=O)C2=CC=C(Cl)C=C2)=CC=C1

IUPAC: 4-{3-[2-(4-chlorophenyl)-2-oxoethoxy]phenyl}-8-methyl-4-azatricyclo[5.2.1.0²,?]dec-8-ene-3,5-dione

InChI: InChI=1/C24H20ClNO4/c1-13-9-15-10-19(13)22-21(15)23(28)26(24(22)29)17-3-2-4-18(11-17)30-12-20(27)14-5-7-16(25)8-6-14/h2-9,11,15,19,21-22H,10,12H2,1H3

Composition: C (68.33%), H (4.78%), Cl (8.40%), N (3.32%), O (15.17%)

Molar Mass: 421.88

Atom Count: 50

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 4
Exact Mass 421.1080858
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey APKSTEJJYSYRHB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 112.77
Topological Polar Surface Area 63.68
Polarizability 43.47
Ring Count 5
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H20ClNO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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