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2-(methylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbaldehyde

2-(methylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbaldehyde

Formula: C7H6N4OS

SMILES: CSC1=NN2C=C(C=O)C=NC2=N1

IUPAC: 2-(methylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbaldehyde

InChI: InChI=1S/C7H6N4OS/c1-13-7-9-6-8-2-5(4-12)3-11(6)10-7/h2-4H,1H3

Composition: C (43.29%), H (3.11%), N (28.85%), O (8.24%), S (16.51%)

Molar Mass: 194.21

Atom Count: 19

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 194.026232003
Formal Charge 0
FSP3 0.14
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey MBQBMKOFQJQZJJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.89
Topological Polar Surface Area 60.15
Polarizability 18.4
Ring Count 2
Rotatable Bond Count 2

Suppliers

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Life Chemicals USA, Inc.
Supplier Profile
Purity LeadTime Formula PacketSize UnitPrice
95% <7 Days C7H6N4OS $191.07-$2,740.32$191.07$337.59$594.99$1,298.88$1,956.24$2,740.32
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Kinentia Biosciences LLC
Supplier Profile
Purity LeadTime Formula PacketSize UnitPrice
97% <14 Days C7H6N4OS $181.44-$272.16$181.44$272.16
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