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N-(2,4-dimethylphenyl)-2-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}propanamide

N-(2,4-dimethylphenyl)-2-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}propanamide

Formula: C22H24N2O3

SMILES: CC(N1C(=O)C2C(C3C=CC2C2CC32)C1=O)C(=O)NC1=CC=C(C)C=C1C

IUPAC: N-(2,4-dimethylphenyl)-2-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}propanamide

InChI: InChI=1/C22H24N2O3/c1-10-4-7-17(11(2)8-10)23-20(25)12(3)24-21(26)18-13-5-6-14(16-9-15(13)16)19(18)22(24)27/h4-8,12-16,18-19H,9H2,1-3H3,(H,23,25)

Composition: C (72.51%), H (6.64%), N (7.69%), O (13.17%)

Molar Mass: 364.445

Atom Count: 51

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 7
Exact Mass 364.178692641
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XHKGLSKZVRERJG-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 103.77
Topological Polar Surface Area 66.48
Polarizability 38.97
Ring Count 5
Rotatable Bond Count 3

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H24N2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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