2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine

C88H51Cl3F14N20O — CID 162252800

IUPAC2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine
SMILESCOc1cccc2c(Nc3n[nH]c4ccccc34)nc(-c3ccccc3C(F)(F)F)nc12.Fc1cc(F)c2[nH]nc(Nc3nc(-c4cc(C(F)(F)F)ccc4Cl)nc4ccccc34)c2c1.Fc1cc(F)c2[nH]nc(Nc3nc(-c4ccc(Cl)cc4Cl)nc4ccccc34)c2c1.Fc1cccc2[nH]nc(Nc3nc(-c4ccccc4C(F)(F)F)nc4ccccc34)c12
InChIInChI=1S/C23H16F3N5O.C22H11ClF5N5.C22H13F4N5.C21H11Cl2F2N5/c1-32-18-12-6-9-15-19(18)27-20(13-7-2-4-10-16(13)23(24,25)26)28-21(15)29-22-14-8-3-5-11-17(14)30-31-22;23-15-6-5-10(22(26,27)28)7-13(15)20-29-17-4-2-1-3-12(17)19(30-20)31-21-14-8-11(24)9-16(25)18(14)32-33-21;23-15-9-5-11-17-18(15)21(31-30-17)29-20-13-7-2-4-10-16(13)27-19(28-20)12-6-1-3-8-14(12)22(24,25)26;22-10-5-6-12(15(23)7-10)19-26-17-4-2-1-3-13(17)20(27-19)28-21-14-8-11(24)9-16(25)18(14)29-30-21/h2-12H,1H3,(H2,27,28,29,30,31);1-9H,(H2,29,30,31,32,33);1-11H,(H2,27,28,29,30,31);1-9H,(H2,26,27,28,29,30)
InChIKeyZYFASSLBDOPQPT-UHFFFAOYSA-N
MW1776.85 g/mol
LogP25.39
Rot. Bonds13

About 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine

2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine (PubChem CID 162252800) has the molecular formula C88H51Cl3F14N20O and a molecular weight of 1776.85 g/mol. Its IUPAC name is 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine.

Molecular Properties

Compound Name2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine
PubChem CID162252800
Molecular FormulaC88H51Cl3F14N20O
Molecular Weight1776.85 g/mol
Exact Mass1774.34
IUPAC Name2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine
SMILESCOc1cccc2c(Nc3n[nH]c4ccccc34)nc(-c3ccccc3C(F)(F)F)nc12.Fc1cc(F)c2[nH]nc(Nc3nc(-c4cc(C(F)(F)F)ccc4Cl)nc4ccccc34)c2c1.Fc1cc(F)c2[nH]nc(Nc3nc(-c4ccc(Cl)cc4Cl)nc4ccccc34)c2c1.Fc1cccc2[nH]nc(Nc3nc(-c4ccccc4C(F)(F)F)nc4ccccc34)c12
InChIInChI=1S/C23H16F3N5O.C22H11ClF5N5.C22H13F4N5.C21H11Cl2F2N5/c1-32-18-12-6-9-15-19(18)27-20(13-7-2-4-10-16(13)23(24,25)26)28-21(15)29-22-14-8-3-5-11-17(14)30-31-22;23-15-6-5-10(22(26,27)28)7-13(15)20-29-17-4-2-1-3-12(17)19(30-20)31-21-14-8-11(24)9-16(25)18(14)32-33-21;23-15-9-5-11-17-18(15)21(31-30-17)29-20-13-7-2-4-10-16(13)27-19(28-20)12-6-1-3-8-14(12)22(24,25)26;22-10-5-6-12(15(23)7-10)19-26-17-4-2-1-3-13(17)20(27-19)28-21-14-8-11(24)9-16(25)18(14)29-30-21/h2-12H,1H3,(H2,27,28,29,30,31);1-9H,(H2,29,30,31,32,33);1-11H,(H2,27,28,29,30,31);1-9H,(H2,26,27,28,29,30)
InChIKeyZYFASSLBDOPQPT-UHFFFAOYSA-N
XLogP25.39
TPSA275.19 Ų
H-Bond Donors8
H-Bond Acceptors17
Rotatable Bonds13
Heavy Atoms126
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001776.85
LogP ≤ 525.39
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1017

Analyze 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine with MolForge

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Related Compounds

4-N-(4-fluorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;methane;4-N-(2-methoxyphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;3-methyl-N-[4-(trifluoromethyl)phenyl]-2H-pyrazolo[4,3-c]quinolin-4-amine
CID 159518784
N-(4-chloro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-[5-(methoxymethyl)-1H-pyrazol-3-yl]-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine
CID 160080106
4-N-(4-chlorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;4-N-(4-fluorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;methane;4-N-(2-methoxyphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;4-N-(4-methylphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;3-methyl-N-[4-(trifluoromethyl)phenyl]-2H-pyrazolo[4,3-c]quinolin-4-amine
CID 160278025
[3-chloro-4-[4-[(5,7-difluoro-1H-indazol-3-yl)amino]quinazolin-2-yl]phenyl] nitrate;N-(5,7-difluoro-1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(5-fluoro-1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(7-fluoro-1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine
CID 160591902
8-(2-aminoethoxy)-N-(1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(7-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]pyrimido[4,5-d]pyrimidin-4-amine;5-N-(1H-indazol-3-yl)-7-[2-(trifluoromethyl)phenyl]pyrimido[4,5-d]pyrimidine-2,5-diamine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine
CID 161025403
7-chloro-N-(5-methyl-1H-1,2,4-triazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;2-(4-chloro-3-pyridinyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;8-methoxy-N-(5-methyl-1H-1,2,4-triazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;7-methyl-N-(5-methyl-1H-1,2,4-triazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine
CID 161732666
4-N-(4-chlorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;4-N-(4-fluorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;4-N-(2-methoxyphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine;4-N-(4-methylphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 157744998
2-(4-chloronaphthalen-1-yl)-N-(1H-indazol-3-yl)quinazolin-4-amine;2-[4-[(5,7-difluoro-1H-indazol-3-yl)amino]quinazolin-2-yl]benzonitrile;2-[4-(1H-indazol-3-ylamino)quinazolin-2-yl]-5-methoxybenzonitrile;N-(1H-indazol-3-yl)-2-(2-nitrophenyl)quinazolin-4-amine
CID 160341304
2-[2-(2-Chloro-5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)ethyl]-7-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-5-amine;7-methoxy-2-[2-[2-(4-methylpiperazin-1-yl)-5,7-dihydropyrrolo[3,4-b]pyridin-6-yl]ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine;1-methylpiperidine
CID 161572956

Frequently Asked Questions

What is the IUPAC name of 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine?
The IUPAC name of 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine (CID 162252800) is 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine.
What is the SMILES notation for 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine?
The canonical SMILES for 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine is COc1cccc2c(Nc3n[nH]c4ccccc34)nc(-c3ccccc3C(F)(F)F)nc12.Fc1cc(F)c2[nH]nc(Nc3nc(-c4cc(C(F)(F)F)ccc4Cl)nc4ccccc34)c2c1.Fc1cc(F)c2[nH]nc(Nc3nc(-c4ccc(Cl)cc4Cl)nc4ccccc34)c2c1.Fc1cccc2[nH]nc(Nc3nc(-c4ccccc4C(F)(F)F)nc4ccccc34)c12.
What is the InChIKey of 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine?
The InChIKey is ZYFASSLBDOPQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16F3N5O.C22H11ClF5N5.C22H13F4N5.C21H11Cl2F2N5/c1-32-18-12-6-9-15-19(18)27-20(13-7-2-4-10-16(13)23(24,25)26)28-21(15)29-22-14-8-3-5-11-17(14)30-31-22;23-15-6-5-10(22(26,27)28)7-13(15)20-29-17-4-2-1-3-12(17)19(30-20)31-21-14-8-11(24)9-16(25)18(14)32-33-21;23-15-9-5-11-17-18(15)21(31-30-17)29-20-13-7-2-4-10-16(13)27-19(28-20)12-6-1-3-8-14(12)22(24,25)26;22-10-5-6-12(15(23)7-10)19-26-17-4-2-1-3-13(17)20(27-19)28-21-14-8-11(24)9-16(25)18(14)29-30-21/h2-12H,1H3,(H2,27,28,29,30,31);1-9H,(H2,29,30,31,32,33);1-11H,(H2,27,28,29,30,31);1-9H,(H2,26,27,28,29,30).
What are the key properties of 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine?
2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine has a molecular weight of 1776.85 g/mol, XLogP of 25.39, 13 rotatable bonds, 8 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloro-5-(trifluoromethyl)phenyl]-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;2-(2,4-dichlorophenyl)-N-(5,7-difluoro-1H-indazol-3-yl)quinazolin-4-amine;N-(4-fluoro-1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine;N-(1H-indazol-3-yl)-8-methoxy-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine is sourced from PubChem (CID 162252800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).