4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one

C60H44BrF4N11O6 — CID 159678635

IUPAC4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one
SMILESCOc1ccc2nc(-c3cccnc3)[nH]c(=O)c2c1.COc1ccc2nc(-c3cccnc3)nc(Br)c2c1.COc1ccc2nc(-c3cccnc3)nc(N3CC(=O)Cc4cc(F)c(F)cc43)c2c1.O=C1CNc2cc(F)c(F)cc2C1
InChIInChI=1S/C23H16F2N4O2.C14H10BrN3O.C14H11N3O2.C9H7F2NO/c1-31-16-4-5-20-17(9-16)23(28-22(27-20)13-3-2-6-26-11-13)29-12-15(30)7-14-8-18(24)19(25)10-21(14)29;1-19-10-4-5-12-11(7-10)13(15)18-14(17-12)9-3-2-6-16-8-9;1-19-10-4-5-12-11(7-10)14(18)17-13(16-12)9-3-2-6-15-8-9;10-7-2-5-1-6(13)4-12-9(5)3-8(7)11/h2-6,8-11H,7,12H2,1H3;2-8H,1H3;2-8H,1H3,(H,16,17,18);2-3,12H,1,4H2
InChIKeyMUXWXYUDSCZNFN-UHFFFAOYSA-N
MW1170.98 g/mol
LogP11.20
Rot. Bonds7

About 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one

4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one (PubChem CID 159678635) has the molecular formula C60H44BrF4N11O6 and a molecular weight of 1170.98 g/mol. Its IUPAC name is 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one.

Molecular Properties

Compound Name4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one
PubChem CID159678635
Molecular FormulaC60H44BrF4N11O6
Molecular Weight1170.98 g/mol
Exact Mass1169.26
IUPAC Name4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one
SMILESCOc1ccc2nc(-c3cccnc3)[nH]c(=O)c2c1.COc1ccc2nc(-c3cccnc3)nc(Br)c2c1.COc1ccc2nc(-c3cccnc3)nc(N3CC(=O)Cc4cc(F)c(F)cc43)c2c1.O=C1CNc2cc(F)c(F)cc2C1
InChIInChI=1S/C23H16F2N4O2.C14H10BrN3O.C14H11N3O2.C9H7F2NO/c1-31-16-4-5-20-17(9-16)23(28-22(27-20)13-3-2-6-26-11-13)29-12-15(30)7-14-8-18(24)19(25)10-21(14)29;1-19-10-4-5-12-11(7-10)13(15)18-14(17-12)9-3-2-6-16-8-9;1-19-10-4-5-12-11(7-10)14(18)17-13(16-12)9-3-2-6-15-8-9;10-7-2-5-1-6(13)4-12-9(5)3-8(7)11/h2-6,8-11H,7,12H2,1H3;2-8H,1H3;2-8H,1H3,(H,16,17,18);2-3,12H,1,4H2
InChIKeyMUXWXYUDSCZNFN-UHFFFAOYSA-N
XLogP11.20
TPSA213.08 Ų
H-Bond Donors2
H-Bond Acceptors16
Rotatable Bonds7
Heavy Atoms82
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001170.98
LogP ≤ 511.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1016

Analyze 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3-fluorophenyl)-N-[1-(6-methoxyquinazolin-4-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 67268129
2-[[2-(5-Fluoro-3-pyridinyl)-6-methoxyquinazolin-4-yl]amino]benzamide
CID 71179813
2-fluoro-6-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-N-methylbenzamide
CID 71179826
2-Fluoro-6-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 71180040
4-Fluoro-2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 71180076
5-Fluoro-2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 71180366
N-[(4-fluorophenyl)methyl]-2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 71180489
N-[2-(2-fluorophenyl)ethyl]-2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide
CID 71274355
2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-N-[1-[2-(trifluoromethyl)phenyl]ethyl]benzamide
CID 71274357
2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 71274358
2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-N-[1-[3-(trifluoromethyl)phenyl]ethyl]benzamide
CID 71274359
2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-N-[1-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 71274360

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one?
The IUPAC name of 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one (CID 159678635) is 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one.
What is the SMILES notation for 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one?
The canonical SMILES for 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one is COc1ccc2nc(-c3cccnc3)[nH]c(=O)c2c1.COc1ccc2nc(-c3cccnc3)nc(Br)c2c1.COc1ccc2nc(-c3cccnc3)nc(N3CC(=O)Cc4cc(F)c(F)cc43)c2c1.O=C1CNc2cc(F)c(F)cc2C1.
What is the InChIKey of 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one?
The InChIKey is MUXWXYUDSCZNFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16F2N4O2.C14H10BrN3O.C14H11N3O2.C9H7F2NO/c1-31-16-4-5-20-17(9-16)23(28-22(27-20)13-3-2-6-26-11-13)29-12-15(30)7-14-8-18(24)19(25)10-21(14)29;1-19-10-4-5-12-11(7-10)13(15)18-14(17-12)9-3-2-6-16-8-9;1-19-10-4-5-12-11(7-10)14(18)17-13(16-12)9-3-2-6-15-8-9;10-7-2-5-1-6(13)4-12-9(5)3-8(7)11/h2-6,8-11H,7,12H2,1H3;2-8H,1H3;2-8H,1H3,(H,16,17,18);2-3,12H,1,4H2.
What are the key properties of 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one?
4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one has a molecular weight of 1170.98 g/mol, XLogP of 11.20, 7 rotatable bonds, 2 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-methoxy-2-pyridin-3-ylquinazoline;6,7-difluoro-2,4-dihydro-1H-quinolin-3-one;6,7-difluoro-1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-2,4-dihydroquinolin-3-one;6-methoxy-2-pyridin-3-yl-3H-quinazolin-4-one is sourced from PubChem (CID 159678635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).