[4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide

C78H63ClF9N13O3S2 — CID 162111812

About [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide

[4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide (PubChem CID 162111812) has the molecular formula C78H63ClF9N13O3S2 and a molecular weight of 1501.02 g/mol. Its IUPAC name is [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide.

Molecular Properties

• Compound Name: [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide
• PubChem CID: 162111812
• Molecular Formula: C78H63ClF9N13O3S2
• Molecular Weight: 1501.02 g/mol
• Exact Mass: 1499.42
• IUPAC Name: [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide
• SMILES: Cc1ccc(CNc2nn(Cc3ccc(C(F)(F)F)cc3)c3ccccc23)cc1.Cc1ccsc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Nc1nn(Cc2ccc(CO)cc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1csc(Cl)n1
• InChI: InChI=1S/C23H20F3N3.C21H16F3N3OS.C19H12ClF3N4OS.C15H15N3O/c1-16-6-8-17(9-7-16)14-27-22-20-4-2-3-5-21(20)29(28-22)15-18-10-12-19(13-11-18)23(24,25)26;1-13-10-11-29-18(13)20(28)25-19-16-4-2-3-5-17(16)27(26-19)12-14-6-8-15(9-7-14)21(22,23)24;20-18-24-14(10-29-18)17(28)25-16-13-3-1-2-4-15(13)27(26-16)9-11-5-7-12(8-6-11)19(21,22)23;16-15-13-3-1-2-4-14(13)18(17-15)9-11-5-7-12(10-19)8-6-11/h2-13H,14-15H2,1H3,(H,27,28);2-11H,12H2,1H3,(H,25,26,28);1-8,10H,9H2,(H,25,26,28);1-8,19H,9-10H2,(H2,16,17)
• InChIKey: ZGGDVTKKSDCATC-UHFFFAOYSA-N
• XLogP: 19.37
• TPSA: 200.65 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 16
• Rotatable Bonds: 16
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1501.02
LogP ≤ 5	19.37
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide?

The IUPAC name of [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide (CID 162111812) is [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide.

What is the SMILES notation for [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide?

The canonical SMILES for [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide is Cc1ccc(CNc2nn(Cc3ccc(C(F)(F)F)cc3)c3ccccc23)cc1.Cc1ccsc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Nc1nn(Cc2ccc(CO)cc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1csc(Cl)n1.

What is the InChIKey of [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide?

The InChIKey is ZGGDVTKKSDCATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F3N3.C21H16F3N3OS.C19H12ClF3N4OS.C15H15N3O/c1-16-6-8-17(9-7-16)14-27-22-20-4-2-3-5-21(20)29(28-22)15-18-10-12-19(13-11-18)23(24,25)26;1-13-10-11-29-18(13)20(28)25-19-16-4-2-3-5-17(16)27(26-19)12-14-6-8-15(9-7-14)21(22,23)24;20-18-24-14(10-29-18)17(28)25-16-13-3-1-2-4-15(13)27(26-16)9-11-5-7-12(8-6-11)19(21,22)23;16-15-13-3-1-2-4-14(13)18(17-15)9-11-5-7-12(10-19)8-6-11/h2-13H,14-15H2,1H3,(H,27,28);2-11H,12H2,1H3,(H,25,26,28);1-8,10H,9H2,(H,25,26,28);1-8,19H,9-10H2,(H2,16,17).

What are the key properties of [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide?

[4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide has a molecular weight of 1501.02 g/mol, XLogP of 19.37, 16 rotatable bonds, 5 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[(3-aminoindazol-1-yl)methyl]phenyl]methanol;2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-4-carboxamide;N-[(4-methylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]thiophene-2-carboxamide is sourced from PubChem (CID 162111812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).