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1-[2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamido]-N-(3-methylphenyl)cyclopentane-1-carboxamide

1-[2-(2,4-dichlorophenoxy)-N-(furan-2-ylmethyl)acetamido]-N-(3-methylphenyl)cyclopentane-1-carboxamide

Formula: C26H26Cl2N2O4

SMILES: CC1=CC(NC(=O)C2(CCCC2)N(CC2=CC=CO2)C(=O)COC2=CC=C(Cl)C=C2Cl)=CC=C1

IUPAC: 1-[2-(2,4-dichlorophenoxy)-N-[(furan-2-yl)methyl]acetamido]-N-(3-methylphenyl)cyclopentane-1-carboxamide

InChI: InChI=1S/C26H26Cl2N2O4/c1-18-6-4-7-20(14-18)29-25(32)26(11-2-3-12-26)30(16-21-8-5-13-33-21)24(31)17-34-23-10-9-19(27)15-22(23)28/h4-10,13-15H,2-3,11-12,16-17H2,1H3,(H,29,32)

Composition: C (62.28%), H (5.23%), Cl (14.14%), N (5.59%), O (12.76%)

Molar Mass: 501.4

Atom Count: 60

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 500.1269627
Formal Charge 0
FSP3 0.31
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey AXNJSDHQRHNFLL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 132.69
Topological Polar Surface Area 71.78
Polarizability 50.87
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H26Cl2N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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