7-chloro-2-(4-chlorophenyl)-8-methylquinoline-4-carboxylic acid

7-chloro-2-(4-chlorophenyl)-8-methylquinoline-4-carboxylic acid

CAS: 500356-69-4

Formula: C17H11Cl2NO2

SMILES: CC1=C(Cl)C=CC2=C(C=C(N=C12)C1=CC=C(Cl)C=C1)C(O)=O

IUPAC: 7-chloro-2-(4-chlorophenyl)-8-methylquinoline-4-carboxylic acid

InChI: InChI=1S/C17H11Cl2NO2/c1-9-14(19)7-6-12-13(17(21)22)8-15(20-16(9)12)10-2-4-11(18)5-3-10/h2-8H,1H3,(H,21,22)

Composition: C (61.47%), H (3.34%), Cl (21.34%), N (4.22%), O (9.63%)

Molar Mass: 332.18

Atom Count: 33

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	331.016684
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	MTNHOZGHNSNVRP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	86.65
Topological Polar Surface Area	50.19
Polarizability	35.71
Ring Count	3
Rotatable Bond Count	2

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