1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide

C78H61F6N15O6S2 — CID 158700988

IUPAC1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide
SMILESCc1ccc(Cn2nc(NC(=O)c3ccoc3C)c3ccccc32)cc1.Cc1ccc2c(NC(=O)c3ccoc3)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.O=C(Nc1nccs1)c1nn(Cc2ccccc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cscn1
InChIInChI=1S/C21H19N3O2.C20H15F3N4O2.C19H13F3N4OS.C18H14N4OS/c1-14-7-9-16(10-8-14)13-24-19-6-4-3-5-18(19)20(23-24)22-21(25)17-11-12-26-15(17)2;1-12-2-7-16-17(25-19(28)14-8-9-29-11-14)26-27(18(16)24-12)10-13-3-5-15(6-4-13)20(21,22)23;20-19(21,22)13-7-5-12(6-8-13)9-26-16-4-2-1-3-14(16)17(25-26)24-18(27)15-10-28-11-23-15;23-17(20-18-19-10-11-24-18)16-14-8-4-5-9-15(14)22(21-16)12-13-6-2-1-3-7-13/h3-12H,13H2,1-2H3,(H,22,23,25);2-9,11H,10H2,1H3,(H,25,26,28);1-8,10-11H,9H2,(H,24,25,27);1-11H,12H2,(H,19,20,23)
InChIKeyIHNSHNCNZZXOHJ-UHFFFAOYSA-N
MW1482.57 g/mol
LogP17.80
Rot. Bonds16

About 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide

1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide (PubChem CID 158700988) has the molecular formula C78H61F6N15O6S2 and a molecular weight of 1482.57 g/mol. Its IUPAC name is 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide
PubChem CID158700988
Molecular FormulaC78H61F6N15O6S2
Molecular Weight1482.57 g/mol
Exact Mass1481.43
IUPAC Name1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide
SMILESCc1ccc(Cn2nc(NC(=O)c3ccoc3C)c3ccccc32)cc1.Cc1ccc2c(NC(=O)c3ccoc3)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.O=C(Nc1nccs1)c1nn(Cc2ccccc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cscn1
InChIInChI=1S/C21H19N3O2.C20H15F3N4O2.C19H13F3N4OS.C18H14N4OS/c1-14-7-9-16(10-8-14)13-24-19-6-4-3-5-18(19)20(23-24)22-21(25)17-11-12-26-15(17)2;1-12-2-7-16-17(25-19(28)14-8-9-29-11-14)26-27(18(16)24-12)10-13-3-5-15(6-4-13)20(21,22)23;20-19(21,22)13-7-5-12(6-8-13)9-26-16-4-2-1-3-14(16)17(25-26)24-18(27)15-10-28-11-23-15;23-17(20-18-19-10-11-24-18)16-14-8-4-5-9-15(14)22(21-16)12-13-6-2-1-3-7-13/h3-12H,13H2,1-2H3,(H,22,23,25);2-9,11H,10H2,1H3,(H,25,26,28);1-8,10-11H,9H2,(H,24,25,27);1-11H,12H2,(H,19,20,23)
InChIKeyIHNSHNCNZZXOHJ-UHFFFAOYSA-N
XLogP17.80
TPSA252.63 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds16
Heavy Atoms107
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001482.57
LogP ≤ 517.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Analyze 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide (CID 158700988) is 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide is Cc1ccc(Cn2nc(NC(=O)c3ccoc3C)c3ccccc32)cc1.Cc1ccc2c(NC(=O)c3ccoc3)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.O=C(Nc1nccs1)c1nn(Cc2ccccc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cscn1.
What is the InChIKey of 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide?
The InChIKey is IHNSHNCNZZXOHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2.C20H15F3N4O2.C19H13F3N4OS.C18H14N4OS/c1-14-7-9-16(10-8-14)13-24-19-6-4-3-5-18(19)20(23-24)22-21(25)17-11-12-26-15(17)2;1-12-2-7-16-17(25-19(28)14-8-9-29-11-14)26-27(18(16)24-12)10-13-3-5-15(6-4-13)20(21,22)23;20-19(21,22)13-7-5-12(6-8-13)9-26-16-4-2-1-3-14(16)17(25-26)24-18(27)15-10-28-11-23-15;23-17(20-18-19-10-11-24-18)16-14-8-4-5-9-15(14)22(21-16)12-13-6-2-1-3-7-13/h3-12H,13H2,1-2H3,(H,22,23,25);2-9,11H,10H2,1H3,(H,25,26,28);1-8,10-11H,9H2,(H,24,25,27);1-11H,12H2,(H,19,20,23).
What are the key properties of 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide?
1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 1482.57 g/mol, XLogP of 17.80, 16 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(1,3-thiazol-2-yl)indazole-3-carboxamide;2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 158700988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).