5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine

C93H80Br5Cl7F6N20O5S3 — CID 159124539

About 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine

5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine (PubChem CID 159124539) has the molecular formula C93H80Br5Cl7F6N20O5S3 and a molecular weight of 2415.68 g/mol. Its IUPAC name is 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine.

Molecular Properties

• Compound Name: 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine
• PubChem CID: 159124539
• Molecular Formula: C93H80Br5Cl7F6N20O5S3
• Molecular Weight: 2415.68 g/mol
• Exact Mass: 2405.94
• IUPAC Name: 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine
• SMILES: C1CCNCC1.CCNN.CCn1nc2c(Cl)cc(Br)cc2c1N.CCn1nc2c(Cl)cc(Br)cc2c1N(C)c1nc(-c2ccc(F)cc2)c(C#N)s1.CCn1nc2c(Cl)cc(N3CCCCC3)cc2c1N(C)c1nc(-c2ccc(F)cc2)c(C#N)s1.Fc1ccc(Br)cc1Cl.N#Cc1cc(Br)cc(Cl)c1F.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.O=C(O)C(=O)O.O=Cc1cc(Br)cc(Cl)c1F
• InChI: InChI=1S/C25H24ClFN6S.C20H14BrClFN5S.C10H4ClFN2S.C9H9BrClN3.C7H2BrClFN.C7H3BrClFO.C6H3BrClF.C5H11N.C2H8N2.C2H2O4/c1-3-33-24(19-13-18(14-20(26)23(19)30-33)32-11-5-4-6-12-32)31(2)25-29-22(21(15-28)34-25)16-7-9-17(27)10-8-16;1-3-28-19(14-8-12(21)9-15(22)18(14)26-28)27(2)20-25-17(16(10-24)29-20)11-4-6-13(23)7-5-11;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;1-2-14-9(12)6-3-5(10)4-7(11)8(6)13-14;2*8-5-1-4(3-11)7(10)6(9)2-5;7-4-1-2-6(9)5(8)3-4;1-2-4-6-5-3-1;1-2-4-3;3-1(4)2(5)6/h7-10,13-14H,3-6,11-12H2,1-2H3;4-9H,3H2,1-2H3;1-4H;3-4H,2,12H2,1H3;1-2H;1-3H;1-3H;6H,1-5H2;4H,2-3H2,1H3;(H,3,4)(H,5,6)
• InChIKey: DXVBWYZKVFPGBE-UHFFFAOYSA-N
• XLogP: 28.30
• TPSA: 364.78 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 26
• Rotatable Bonds: 13
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2415.68
LogP ≤ 5	28.30
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine?

The IUPAC name of 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine (CID 159124539) is 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine.

What is the SMILES notation for 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine?

The canonical SMILES for 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine is C1CCNCC1.CCNN.CCn1nc2c(Cl)cc(Br)cc2c1N.CCn1nc2c(Cl)cc(Br)cc2c1N(C)c1nc(-c2ccc(F)cc2)c(C#N)s1.CCn1nc2c(Cl)cc(N3CCCCC3)cc2c1N(C)c1nc(-c2ccc(F)cc2)c(C#N)s1.Fc1ccc(Br)cc1Cl.N#Cc1cc(Br)cc(Cl)c1F.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.O=C(O)C(=O)O.O=Cc1cc(Br)cc(Cl)c1F.

What is the InChIKey of 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine?

The InChIKey is DXVBWYZKVFPGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24ClFN6S.C20H14BrClFN5S.C10H4ClFN2S.C9H9BrClN3.C7H2BrClFN.C7H3BrClFO.C6H3BrClF.C5H11N.C2H8N2.C2H2O4/c1-3-33-24(19-13-18(14-20(26)23(19)30-33)32-11-5-4-6-12-32)31(2)25-29-22(21(15-28)34-25)16-7-9-17(27)10-8-16;1-3-28-19(14-8-12(21)9-15(22)18(14)26-28)27(2)20-25-17(16(10-24)29-20)11-4-6-13(23)7-5-11;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;1-2-14-9(12)6-3-5(10)4-7(11)8(6)13-14;2*8-5-1-4(3-11)7(10)6(9)2-5;7-4-1-2-6(9)5(8)3-4;1-2-4-6-5-3-1;1-2-4-3;3-1(4)2(5)6/h7-10,13-14H,3-6,11-12H2,1-2H3;4-9H,3H2,1-2H3;1-4H;3-4H,2,12H2,1H3;1-2H;1-3H;1-3H;6H,1-5H2;4H,2-3H2,1H3;(H,3,4)(H,5,6).

What are the key properties of 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine?

5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine has a molecular weight of 2415.68 g/mol, XLogP of 28.30, 13 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-7-chloro-2-ethylindazol-3-amine;2-[(5-bromo-7-chloro-2-ethylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-3-chloro-2-fluorobenzaldehyde;4-bromo-2-chloro-1-fluorobenzene;5-bromo-3-chloro-2-fluorobenzonitrile;2-[(7-chloro-2-ethyl-5-piperidin-1-ylindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;ethylhydrazine;oxalic acid;piperidine is sourced from PubChem (CID 159124539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).