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4-[4-(2,4-dichlorophenoxy)butanehydrazido]-N-(3,4-dimethylphenyl)-4-oxobutanamide

4-[4-(2,4-dichlorophenoxy)butanehydrazido]-N-(3,4-dimethylphenyl)-4-oxobutanamide

Formula: C22H25Cl2N3O4

SMILES: CC1=CC=C(NC(=O)CCC(=O)NNC(=O)CCCOC2=CC=C(Cl)C=C2Cl)C=C1C

IUPAC: 4-[4-(2,4-dichlorophenoxy)butanehydrazido]-N-(3,4-dimethylphenyl)-4-oxobutanamide

InChI: InChI=1S/C22H25Cl2N3O4/c1-14-5-7-17(12-15(14)2)25-20(28)9-10-22(30)27-26-21(29)4-3-11-31-19-8-6-16(23)13-18(19)24/h5-8,12-13H,3-4,9-11H2,1-2H3,(H,25,28)(H,26,29)(H,27,30)

Composition: C (56.66%), H (5.40%), Cl (15.20%), N (9.01%), O (13.72%)

Molar Mass: 466.36

Atom Count: 56

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 465.1222117
Formal Charge 0
FSP3 0.32
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey OJBUIYMAJGFVHB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 121.61
Topological Polar Surface Area 96.53
Polarizability 46.31
Ring Count 2
Rotatable Bond Count 10

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H25Cl2N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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