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7-[1-(3,5-dimethylphenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

7-[1-(3,5-dimethylphenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

CAS: 306979-66-8

Formula: C15H17N5O

SMILES: CC(OC1=CC(C)=CC(C)=C1)C1=CC=NC2=NC(N)=NN12

IUPAC: 7-[1-(3,5-dimethylphenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

InChI: InChI=1/C15H17N5O/c1-9-6-10(2)8-12(7-9)21-11(3)13-4-5-17-15-18-14(16)19-20(13)15/h4-8,11H,1-3H3,(H2,16,19)

Composition: C (63.59%), H (6.05%), N (24.72%), O (5.65%)

Molar Mass: 283.335

Atom Count: 38

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 283.143310187
Formal Charge 0
FSP3 0.27
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey KDUIDBRJNDIFTO-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.71
Topological Polar Surface Area 78.33
Polarizability 30.13
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 306979-66-8 $51.35-$524.40$51.35$63.37$86.31$524.40
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