2-[(4-aminophenyl)sulfanyl]-N-(2,3,5,6-tetrafluorophenyl)propanamide

2-[(4-aminophenyl)sulfanyl]-N-(2,3,5,6-tetrafluorophenyl)propanamide

CAS: 913244-32-3

Formula: C15H12F4N2OS

SMILES: CC(SC1=CC=C(N)C=C1)C(=O)NC1=C(F)C(F)=CC(F)=C1F

IUPAC: 2-[(4-aminophenyl)sulfanyl]-N-(2,3,5,6-tetrafluorophenyl)propanamide

InChI: InChI=1/C15H12F4N2OS/c1-7(23-9-4-2-8(20)3-5-9)15(22)21-14-12(18)10(16)6-11(17)13(14)19/h2-7H,20H2,1H3,(H,21,22)

Composition: C (52.32%), H (3.51%), F (22.07%), N (8.14%), O (4.65%), S (9.31%)

Molar Mass: 344.33

Atom Count: 35

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	344.06064684
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	FPNHKHPLCFNOOU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.39
Topological Polar Surface Area	55.12
Polarizability	29.75
Ring Count	2
Rotatable Bond Count	4

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