3-amino-6-(1,1,2,2,3,3,3-heptafluoropropyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide

3-amino-6-(1,1,2,2,3,3,3-heptafluoropropyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide

CAS: 828276-24-0

Formula: C12H8F7N3OS

SMILES: CC1=C2C(N)=C(SC2=NC(=C1)C(F)(F)C(F)(F)C(F)(F)F)C(N)=O

IUPAC: 3-amino-6-(1,1,2,2,3,3,3-heptafluoropropyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide

InChI: InChI=1S/C12H8F7N3OS/c1-3-2-4(10(13,14)11(15,16)12(17,18)19)22-9-5(3)6(20)7(24-9)8(21)23/h2H,20H2,1H3,(H2,21,23)

Composition: C (38.41%), H (2.15%), F (35.44%), N (11.20%), O (4.26%), S (8.54%)

Molar Mass: 375.26

Atom Count: 32

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	375.027630205
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	WECPKZKTCXTBDS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.74
Topological Polar Surface Area	82
Polarizability	25.4
Ring Count	2
Rotatable Bond Count	4

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