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4-amino-N-[(2,4-dichlorophenyl)methoxy]-N'-(2,4-dimethylphenyl)-1,2,5-oxadiazole-3-carboximidamide

4-amino-N-[(2,4-dichlorophenyl)methoxy]-N'-(2,4-dimethylphenyl)-1,2,5-oxadiazole-3-carboximidamide

Formula: C18H17Cl2N5O2

SMILES: CC1=CC=C(N=C(NOCC2=CC=C(Cl)C=C2Cl)C2=NON=C2N)C(C)=C1

IUPAC: 4-amino-N-[(2,4-dichlorophenyl)methoxy]-N'-(2,4-dimethylphenyl)-1,2,5-oxadiazole-3-carboximidamide

InChI: InChI=1S/C18H17Cl2N5O2/c1-10-3-6-15(11(2)7-10)22-18(16-17(21)24-27-23-16)25-26-9-12-4-5-13(19)8-14(12)20/h3-8H,9H2,1-2H3,(H2,21,24)(H,22,25)

Composition: C (53.22%), H (4.22%), Cl (17.45%), N (17.24%), O (7.88%)

Molar Mass: 406.27

Atom Count: 44

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 405.0759302
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey OHUNCUXJHFATEQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 120.06
Topological Polar Surface Area 98.56
Polarizability 39.33
Ring Count 3
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H17Cl2N5O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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