5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide

C108H86F10N16O9 — CID 158871003

IUPAC5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide
SMILESCOc1ccc(NC(=O)n2c(C)cc3c(F)c(Oc4ncnc5cc(C)c(C)cc45)ccc32)cc1.Cc1cc2ncnc(Oc3ccc4c(cc(C)n4C(=O)Nc4ccc(C(F)(F)F)cc4)c3F)c2cc1C.Cc1cc2ncnc(Oc3ccc4c(cc(C)n4C(=O)Nc4ccccc4C(F)(F)F)c3F)c2cc1C.Cc1cccc(NC(=O)n2c(C)cc3c(F)c(Oc4ncnc5cc(C)c(C)cc45)ccc32)c1
InChIInChI=1S/2C27H20F4N4O2.C27H23FN4O3.C27H23FN4O2/c1-14-10-19-21(11-15(14)2)32-13-33-25(19)37-23-9-8-22-20(24(23)28)12-16(3)35(22)26(36)34-18-6-4-17(5-7-18)27(29,30)31;1-14-10-17-21(11-15(14)2)32-13-33-25(17)37-23-9-8-22-18(24(23)28)12-16(3)35(22)26(36)34-20-7-5-4-6-19(20)27(29,30)31;1-15-11-20-22(12-16(15)2)29-14-30-26(20)35-24-10-9-23-21(25(24)28)13-17(3)32(23)27(33)31-18-5-7-19(34-4)8-6-18;1-15-6-5-7-19(10-15)31-27(33)32-18(4)13-21-23(32)8-9-24(25(21)28)34-26-20-11-16(2)17(3)12-22(20)29-14-30-26/h2*4-13H,1-3H3,(H,34,36);5-14H,1-4H3,(H,31,33);5-14H,1-4H3,(H,31,33)
InChIKeyJBVMKVQFKWRZDE-UHFFFAOYSA-N
MW1941.96 g/mol
LogP28.44
Rot. Bonds13

About 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide

5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide (PubChem CID 158871003) has the molecular formula C108H86F10N16O9 and a molecular weight of 1941.96 g/mol. Its IUPAC name is 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide.

Molecular Properties

Compound Name5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide
PubChem CID158871003
Molecular FormulaC108H86F10N16O9
Molecular Weight1941.96 g/mol
Exact Mass1940.66
IUPAC Name5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide
SMILESCOc1ccc(NC(=O)n2c(C)cc3c(F)c(Oc4ncnc5cc(C)c(C)cc45)ccc32)cc1.Cc1cc2ncnc(Oc3ccc4c(cc(C)n4C(=O)Nc4ccc(C(F)(F)F)cc4)c3F)c2cc1C.Cc1cc2ncnc(Oc3ccc4c(cc(C)n4C(=O)Nc4ccccc4C(F)(F)F)c3F)c2cc1C.Cc1cccc(NC(=O)n2c(C)cc3c(F)c(Oc4ncnc5cc(C)c(C)cc45)ccc32)c1
InChIInChI=1S/2C27H20F4N4O2.C27H23FN4O3.C27H23FN4O2/c1-14-10-19-21(11-15(14)2)32-13-33-25(19)37-23-9-8-22-20(24(23)28)12-16(3)35(22)26(36)34-18-6-4-17(5-7-18)27(29,30)31;1-14-10-17-21(11-15(14)2)32-13-33-25(17)37-23-9-8-22-18(24(23)28)12-16(3)35(22)26(36)34-20-7-5-4-6-19(20)27(29,30)31;1-15-11-20-22(12-16(15)2)29-14-30-26(20)35-24-10-9-23-21(25(24)28)13-17(3)32(23)27(33)31-18-5-7-19(34-4)8-6-18;1-15-6-5-7-19(10-15)31-27(33)32-18(4)13-21-23(32)8-9-24(25(21)28)34-26-20-11-16(2)17(3)12-22(20)29-14-30-26/h2*4-13H,1-3H3,(H,34,36);5-14H,1-4H3,(H,31,33);5-14H,1-4H3,(H,31,33)
InChIKeyJBVMKVQFKWRZDE-UHFFFAOYSA-N
XLogP28.44
TPSA285.39 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds13
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001941.96
LogP ≤ 528.44
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Analyze 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide with MolForge

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Related Compounds

4-fluoro-5-[[7-(3-methoxypropyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]oxy]-2-methyl-N-[3-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 59394392
5-[(7-ethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)oxy]-4-fluoro-2-methyl-N-[3-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 59394403
5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-[(4-cyclopropylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(diethylamino)-3-(trifluoromethyl)phenyl]indole-1-carboxamide;5-[6-(2-amino-2-oxoethyl)pyrimidin-4-yl]oxy-N-[4-(1-methylpiperidin-4-yl)oxy-3-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 87434510
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-propylindole-1-carboxamide
CID 90352341
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 90352345
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 90352346
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide
CID 90352347
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide
CID 90352348
10-[(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-yl)oxy]-1-(trifluoromethyl)-5H-indolo[1,2-c]quinazolin-6-one
CID 91045043
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 158796309
bis(6-methyl-5-[[3-[9-(oxan-2-yl)purin-6-yl]-2-pyridinyl]methyl]-N-[3-(trifluoromethoxy)phenyl]isoquinolin-1-amine);6-methyl-1-N-[3-(trifluoromethoxy)phenyl]isoquinoline-1,5-diamine
CID 159026080
5-(6,7-dimethoxyquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethoxyquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethoxyquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethoxyquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide
CID 159520462

Frequently Asked Questions

What is the IUPAC name of 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide?
The IUPAC name of 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide (CID 158871003) is 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide.
What is the SMILES notation for 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide?
The canonical SMILES for 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide is COc1ccc(NC(=O)n2c(C)cc3c(F)c(Oc4ncnc5cc(C)c(C)cc45)ccc32)cc1.Cc1cc2ncnc(Oc3ccc4c(cc(C)n4C(=O)Nc4ccc(C(F)(F)F)cc4)c3F)c2cc1C.Cc1cc2ncnc(Oc3ccc4c(cc(C)n4C(=O)Nc4ccccc4C(F)(F)F)c3F)c2cc1C.Cc1cccc(NC(=O)n2c(C)cc3c(F)c(Oc4ncnc5cc(C)c(C)cc45)ccc32)c1.
What is the InChIKey of 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide?
The InChIKey is JBVMKVQFKWRZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C27H20F4N4O2.C27H23FN4O3.C27H23FN4O2/c1-14-10-19-21(11-15(14)2)32-13-33-25(19)37-23-9-8-22-20(24(23)28)12-16(3)35(22)26(36)34-18-6-4-17(5-7-18)27(29,30)31;1-14-10-17-21(11-15(14)2)32-13-33-25(17)37-23-9-8-22-18(24(23)28)12-16(3)35(22)26(36)34-20-7-5-4-6-19(20)27(29,30)31;1-15-11-20-22(12-16(15)2)29-14-30-26(20)35-24-10-9-23-21(25(24)28)13-17(3)32(23)27(33)31-18-5-7-19(34-4)8-6-18;1-15-6-5-7-19(10-15)31-27(33)32-18(4)13-21-23(32)8-9-24(25(21)28)34-26-20-11-16(2)17(3)12-22(20)29-14-30-26/h2*4-13H,1-3H3,(H,34,36);5-14H,1-4H3,(H,31,33);5-14H,1-4H3,(H,31,33).
What are the key properties of 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide?
5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide has a molecular weight of 1941.96 g/mol, XLogP of 28.44, 13 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-N-(4-methoxyphenyl)-2-methylindole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-(3-methylphenyl)indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[2-(trifluoromethyl)phenyl]indole-1-carboxamide;5-(6,7-dimethylquinazolin-4-yl)oxy-4-fluoro-2-methyl-N-[4-(trifluoromethyl)phenyl]indole-1-carboxamide is sourced from PubChem (CID 158871003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).