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7-chloro-N-(4-methylphenyl)-[1,3]thiazolo[5,4-d]pyrimidin-2-amine

7-chloro-N-(4-methylphenyl)-[1,3]thiazolo[5,4-d]pyrimidin-2-amine

CAS: 871266-80-7

Formula: C12H9ClN4S

SMILES: CC1=CC=C(NC2=NC3=C(Cl)N=CN=C3S2)C=C1

IUPAC: 7-chloro-N-(4-methylphenyl)-[1,3]thiazolo[5,4-d]pyrimidin-2-amine

InChI: InChI=1S/C12H9ClN4S/c1-7-2-4-8(5-3-7)16-12-17-9-10(13)14-6-15-11(9)18-12/h2-6H,1H3,(H,16,17)

Composition: C (52.08%), H (3.28%), Cl (12.81%), N (20.25%), S (11.58%)

Molar Mass: 276.74

Atom Count: 27

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 276.0236452
Formal Charge 0
FSP3 0.08
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey XJXOZVKBZZJUHT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.61
Topological Polar Surface Area 50.7
Polarizability 27.66
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
96% <5 Days 871266-80-7 $25.22-$109.71$25.22$41.61$109.71
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