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2-[(4-methanesulfonylphenyl)amino]-1,3-thiazole-4-carboxylic acid

2-[(4-methanesulfonylphenyl)amino]-1,3-thiazole-4-carboxylic acid

Formula: C11H10N2O4S2

SMILES: CS(=O)(=O)C1=CC=C(NC2=NC(=CS2)C(O)=O)C=C1

IUPAC: 2-[(4-methanesulfonylphenyl)amino]-1,3-thiazole-4-carboxylic acid

InChI: InChI=1S/C11H10N2O4S2/c1-19(16,17)8-4-2-7(3-5-8)12-11-13-9(6-18-11)10(14)15/h2-6H,1H3,(H,12,13)(H,14,15)

Composition: C (44.29%), H (3.38%), N (9.39%), O (21.45%), S (21.49%)

Molar Mass: 298.33

Atom Count: 29

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 298.008199158
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey VPCAUJBUMMYMHZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.11
Topological Polar Surface Area 96.36
Polarizability 27.32
Ring Count 2
Rotatable Bond Count 4

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Life Chemicals USA, Inc.
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Purity LeadTime Formula PacketSize UnitPrice
95% <7 Days C11H10N2O4S2 $341.55-$2,974.95$341.55$485.10$693.99$1,387.98$2,081.97$2,974.95
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Purity LeadTime Formula UnitPrice
98% <10 Days C11H10N2O4S2 Quote Only
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