6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one

C139H148BrCl2F4N31O14 — CID 157256836

About 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one

6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one (PubChem CID 157256836) has the molecular formula C139H148BrCl2F4N31O14 and a molecular weight of 2703.72 g/mol. Its IUPAC name is 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one.

Molecular Properties

• Compound Name: 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one
• PubChem CID: 157256836
• Molecular Formula: C139H148BrCl2F4N31O14
• Molecular Weight: 2703.72 g/mol
• Exact Mass: 2700.03
• IUPAC Name: 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one
• SMILES: CNc1ccc2c(=O)n(C)c(C)nc2c1.COc1ccc2c(=O)n(C)c(C)nc2c1.Cc1nc2cc(Cl)ccc2c(=O)n1C.Cc1nc2ccc(Br)cc2c(=O)n1C.Cc1nc2ccc(C(F)(F)F)cc2c(=O)n1C.Cc1nc2ccc(Cl)cc2c(=O)n1C.Cc1nc2ccc(F)cc2c(=O)n1C.Cc1nc2ccccc2c(=O)n1C.Cn1cnc2c3c(ccc2c1=O)NCC3.Cn1cnc2cc(C3=NCCO3)ccc2c1=O.Cn1cnc2cc(NCCCN3CCCC3)ccc2c1=O.Cn1cnc2cc(NCCCN3CCCCC3)ccc2c1=O
• InChI: InChI=1S/C17H24N4O.C16H22N4O.C12H11N3O2.C11H9F3N2O.C11H11N3O.C11H13N3O.C11H12N2O2.C10H9BrN2O.2C10H9ClN2O.C10H9FN2O.C10H10N2O/c1-20-13-19-16-12-14(6-7-15(16)17(20)22)18-8-5-11-21-9-3-2-4-10-21;1-19-12-18-15-11-13(5-6-14(15)16(19)21)17-7-4-10-20-8-2-3-9-20;1-15-7-14-10-6-8(11-13-4-5-17-11)2-3-9(10)12(15)16;1-6-15-9-4-3-7(11(12,13)14)5-8(9)10(17)16(6)2;1-14-6-13-10-7-4-5-12-9(7)3-2-8(10)11(14)15;1-7-13-10-6-8(12-2)4-5-9(10)11(15)14(7)3;1-7-12-10-6-8(15-3)4-5-9(10)11(14)13(7)2;2*1-6-12-9-4-3-7(11)5-8(9)10(14)13(6)2;1-6-12-9-5-7(11)3-4-8(9)10(14)13(6)2;1-6-12-9-4-3-7(11)5-8(9)10(14)13(6)2;1-7-11-9-6-4-3-5-8(9)10(13)12(7)2/h6-7,12-13,18H,2-5,8-11H2,1H3;5-6,11-12,17H,2-4,7-10H2,1H3;2-3,6-7H,4-5H2,1H3;3-5H,1-2H3;2-3,6,12H,4-5H2,1H3;4-6,12H,1-3H3;4-6H,1-3H3;4*3-5H,1-2H3;3-6H,1-2H3
• InChIKey: AWZHVMPDGBMCRI-UHFFFAOYSA-N
• XLogP: 18.88
• TPSA: 504.10 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 45
• Rotatable Bonds: 13
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2703.72
LogP ≤ 5	18.88
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one?

The IUPAC name of 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one (CID 157256836) is 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one.

What is the SMILES notation for 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one?

The canonical SMILES for 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one is CNc1ccc2c(=O)n(C)c(C)nc2c1.COc1ccc2c(=O)n(C)c(C)nc2c1.Cc1nc2cc(Cl)ccc2c(=O)n1C.Cc1nc2ccc(Br)cc2c(=O)n1C.Cc1nc2ccc(C(F)(F)F)cc2c(=O)n1C.Cc1nc2ccc(Cl)cc2c(=O)n1C.Cc1nc2ccc(F)cc2c(=O)n1C.Cc1nc2ccccc2c(=O)n1C.Cn1cnc2c3c(ccc2c1=O)NCC3.Cn1cnc2cc(C3=NCCO3)ccc2c1=O.Cn1cnc2cc(NCCCN3CCCC3)ccc2c1=O.Cn1cnc2cc(NCCCN3CCCCC3)ccc2c1=O.

What is the InChIKey of 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one?

The InChIKey is AWZHVMPDGBMCRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O.C16H22N4O.C12H11N3O2.C11H9F3N2O.C11H11N3O.C11H13N3O.C11H12N2O2.C10H9BrN2O.2C10H9ClN2O.C10H9FN2O.C10H10N2O/c1-20-13-19-16-12-14(6-7-15(16)17(20)22)18-8-5-11-21-9-3-2-4-10-21;1-19-12-18-15-11-13(5-6-14(15)16(19)21)17-7-4-10-20-8-2-3-9-20;1-15-7-14-10-6-8(11-13-4-5-17-11)2-3-9(10)12(15)16;1-6-15-9-4-3-7(11(12,13)14)5-8(9)10(17)16(6)2;1-14-6-13-10-7-4-5-12-9(7)3-2-8(10)11(14)15;1-7-13-10-6-8(12-2)4-5-9(10)11(15)14(7)3;1-7-12-10-6-8(15-3)4-5-9(10)11(14)13(7)2;2*1-6-12-9-4-3-7(11)5-8(9)10(14)13(6)2;1-6-12-9-5-7(11)3-4-8(9)10(14)13(6)2;1-6-12-9-4-3-7(11)5-8(9)10(14)13(6)2;1-7-11-9-6-4-3-5-8(9)10(13)12(7)2/h6-7,12-13,18H,2-5,8-11H2,1H3;5-6,11-12,17H,2-4,7-10H2,1H3;2-3,6-7H,4-5H2,1H3;3-5H,1-2H3;2-3,6,12H,4-5H2,1H3;4-6,12H,1-3H3;4-6H,1-3H3;4*3-5H,1-2H3;3-6H,1-2H3.

What are the key properties of 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one?

6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one has a molecular weight of 2703.72 g/mol, XLogP of 18.88, 13 rotatable bonds, 4 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-2,3-dimethylquinazolin-4-one;6-chloro-2,3-dimethylquinazolin-4-one;7-chloro-2,3-dimethylquinazolin-4-one;7-(4,5-dihydro-1,3-oxazol-2-yl)-3-methylquinazolin-4-one;2,3-dimethyl-7-(methylamino)quinazolin-4-one;2,3-dimethylquinazolin-4-one;2,3-dimethyl-6-(trifluoromethyl)quinazolin-4-one;6-fluoro-2,3-dimethylquinazolin-4-one;7-methoxy-2,3-dimethylquinazolin-4-one;3-methyl-8,9-dihydro-7H-pyrrolo[2,3-h]quinazolin-4-one;3-methyl-7-(3-piperidin-1-ylpropylamino)quinazolin-4-one;3-methyl-7-(3-pyrrolidin-1-ylpropylamino)quinazolin-4-one is sourced from PubChem (CID 157256836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).