3-chloro-N-(4-chlorophenyl)-5-(trifluoromethyl)-N-[2-(trifluoromethyl)pyridin-4-yl]pyridin-2-amine

3-chloro-N-(4-chlorophenyl)-5-(trifluoromethyl)-N-[2-(trifluoromethyl)pyridin-4-yl]pyridin-2-amine

CAS: 339020-16-5

Formula: C18H9Cl2F6N3

SMILES: FC(F)(F)C1=CC(Cl)=C(N=C1)N(C1=CC=C(Cl)C=C1)C1=CC(=NC=C1)C(F)(F)F

IUPAC: 3-chloro-N-(4-chlorophenyl)-5-(trifluoromethyl)-N-[2-(trifluoromethyl)pyridin-4-yl]pyridin-2-amine

InChI: InChI=1S/C18H9Cl2F6N3/c19-11-1-3-12(4-2-11)29(13-5-6-27-15(8-13)18(24,25)26)16-14(20)7-10(9-28-16)17(21,22)23/h1-9H

Composition: C (47.81%), H (2.01%), Cl (15.68%), F (25.21%), N (9.29%)

Molar Mass: 452.18

Atom Count: 38

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	451.0077717
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	STKXTTZPKIJUKL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	96.4
Topological Polar Surface Area	29.02
Polarizability	35.17
Ring Count	3
Rotatable Bond Count	5

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