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6-(2-methylpropane-2-sulfonyl)-3-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

6-(2-methylpropane-2-sulfonyl)-3-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

CAS: 685108-07-0

Formula: C14H16N4O2S2

SMILES: CC(C)(C)S(=O)(=O)C1=C(N)N2N=CC(C3=CSC=C3)=C2N=C1

IUPAC: 6-(2-methylpropane-2-sulfonyl)-3-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

InChI: InChI=1S/C14H16N4O2S2/c1-14(2,3)22(19,20)11-7-16-13-10(9-4-5-21-8-9)6-17-18(13)12(11)15/h4-8H,15H2,1-3H3

Composition: C (49.98%), H (4.79%), N (16.65%), O (9.51%), S (19.06%)

Molar Mass: 336.43

Atom Count: 38

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 336.071468119
Formal Charge 0
FSP3 0.29
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey GDTOXWMNUZDSTB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 97.53
Topological Polar Surface Area 90.35
Polarizability 34.66
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 685108-07-0 $51.35-$86.31$51.35$63.37$86.31
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