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3-amino-N-(4-iodo-2-methylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

3-amino-N-(4-iodo-2-methylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Formula: C17H13F3IN3OS

SMILES: CC1=C2C(N)=C(SC2=NC(=C1)C(F)(F)F)C(=O)NC1=CC=C(I)C=C1C

IUPAC: 3-amino-N-(4-iodo-2-methylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

InChI: InChI=1S/C17H13F3IN3OS/c1-7-5-9(21)3-4-10(7)23-15(25)14-13(22)12-8(2)6-11(17(18,19)20)24-16(12)26-14/h3-6H,22H2,1-2H3,(H,23,25)

Composition: C (41.56%), H (2.67%), F (11.60%), I (25.83%), N (8.55%), O (3.26%), S (6.53%)

Molar Mass: 491.27

Atom Count: 39

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 490.97761
Formal Charge 0
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey YSCKPLNJSXMTCM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 106.26
Topological Polar Surface Area 68.01
Polarizability 38.67
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H13F3IN3OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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