2-(4-ethoxyphenyl)-6,8-dimethylquinoline-4-carboxylic acid

2-(4-ethoxyphenyl)-6,8-dimethylquinoline-4-carboxylic acid

CAS: 438230-44-5

Formula: C20H19NO3

SMILES: CCOC1=CC=C(C=C1)C1=CC(C(O)=O)=C2C=C(C)C=C(C)C2=N1

IUPAC: 2-(4-ethoxyphenyl)-6,8-dimethylquinoline-4-carboxylic acid

InChI: InChI=1S/C20H19NO3/c1-4-24-15-7-5-14(6-8-15)18-11-17(20(22)23)16-10-12(2)9-13(3)19(16)21-18/h5-11H,4H2,1-3H3,(H,22,23)

Composition: C (74.75%), H (5.96%), N (4.36%), O (14.93%)

Molar Mass: 321.376

Atom Count: 43

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	321.136493476
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	HDZCHAZXWZNVBF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.29
Topological Polar Surface Area	59.42
Polarizability	38.16
Ring Count	3
Rotatable Bond Count	4

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