3-amino-4-(thiophen-2-yl)-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

3-amino-4-(thiophen-2-yl)-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

CAS: 421584-77-2

Formula: C13H8F3N3OS2

SMILES: NC(=O)C1=C(N)C2=C(C=C(N=C2S1)C(F)(F)F)C1=CC=CS1

IUPAC: 3-amino-4-(thiophen-2-yl)-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

InChI: InChI=1S/C13H8F3N3OS2/c14-13(15,16)7-4-5(6-2-1-3-21-6)8-9(17)10(11(18)20)22-12(8)19-7/h1-4H,17H2,(H2,18,20)

Composition: C (45.48%), H (2.35%), F (16.60%), N (12.24%), O (4.66%), S (18.68%)

Molar Mass: 343.34

Atom Count: 30

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	343.006088727
Formal Charge	0
FSP3	0.08
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	OFYSRKOWGCPOMZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.38
Topological Polar Surface Area	82
Polarizability	29.7
Ring Count	3
Rotatable Bond Count	3

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