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4-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-amine

4-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-amine

CAS: 499795-93-6

Formula: C14H11FN4S

SMILES: CC1=C(SC(=N1)C1=CC=C(F)C=C1)C1=NC(N)=NC=C1

IUPAC: 4-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-amine

InChI: InChI=1S/C14H11FN4S/c1-8-12(11-6-7-17-14(16)19-11)20-13(18-8)9-2-4-10(15)5-3-9/h2-7H,1H3,(H2,16,17,19)

Composition: C (58.73%), H (3.87%), F (6.64%), N (19.57%), S (11.20%)

Molar Mass: 286.33

Atom Count: 31

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 286.068845707
Formal Charge 0
FSP3 0.07
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VVCYCYMPOJZGMM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 87.03
Topological Polar Surface Area 64.69
Polarizability 30.1
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 499795-93-6 $51.35-$524.40$51.35$63.37$86.31$524.40
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