AC1LX93H

methyl 2-[[6-bromo-2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-pyridin-4-ylthiophene-3-carboxylate

Also Known As: Oprea1_380248|AK-968/41924418|methyl 2-({[6-bromo-2-(4-ethylphenyl)-4-quinolinyl]carbonyl}amino)-4-(4-pyridinyl)-3-thiophenecarboxylate|methyl 2-[[6-bromo-2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4-pyridin-4-ylthiophene-3-carboxylate|methyl 2-({[6-bromo-2-(4-ethylphenyl)quinolin-4-yl]carbonyl}amino)-4-(pyridin-4-yl)thiophene-3-carboxylate|methyl 2-(6-bromo-2-(4-ethylphenyl)quinoline-4-carboxamido)-4-(pyridin-4-yl)thiophene-3-carboxylate|methyl 2-{[6-bromo-2-(4-ethylphenyl)(4-quinolyl)]carbonylamino}-4-(4-pyridyl)t hiophene-3-carboxylate

Molecular Formula	C29H22BrN3O3S
Molecular Weight	571.0565 g/mol
LogP	7.3891
Topological Polar Surface Area	81.18 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	571.0565
Monoisotopic Mass	571.0565
Heavy Atoms	37
Complexity	1615.6075

Chemical Identifiers

CAS Number	438233-73-9
SMILES	CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=NC=C5)C(=O)OC