5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride

C106H94Br4Cl2F10N26O2S4 — CID 159799760

About 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride

5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride (PubChem CID 159799760) has the molecular formula C106H94Br4Cl2F10N26O2S4 and a molecular weight of 2472.87 g/mol. Its IUPAC name is 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride.

Molecular Properties

• Compound Name: 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride
• PubChem CID: 159799760
• Molecular Formula: C106H94Br4Cl2F10N26O2S4
• Molecular Weight: 2472.87 g/mol
• Exact Mass: 2466.29
• IUPAC Name: 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride
• SMILES: C1CCNCC1.CC(C)NN.CN(c1nc(-c2ccc(F)cc2)c(C#N)s1)c1c2cc(Br)cc(F)c2nn1C1CC1.CN(c1nc(-c2ccc(F)cc2)c(C#N)s1)c1c2cc(N3CCN(C(=O)OC(C)(C)C)CC3)cc(F)c2nn1C1CC1.Cl.N#Cc1cc(Br)cc(F)c1F.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.N#Cc1sc(Nc2c3cc(Br)cc(F)c3nn2C2CC2)nc1-c1ccc(F)cc1.Nc1c2cc(Br)cc(F)c2nn1C1CC1
• InChI: InChI=1S/C30H31F2N7O2S.C21H14BrF2N5S.C20H12BrF2N5S.C10H9BrFN3.C10H4ClFN2S.C7H2BrF2N.C5H11N.C3H10N2.ClH/c1-30(2,3)41-29(40)38-13-11-37(12-14-38)21-15-22-26(23(32)16-21)35-39(20-9-10-20)27(22)36(4)28-34-25(24(17-33)42-28)18-5-7-19(31)8-6-18;1-28(21-26-18(17(10-25)30-21)11-2-4-13(23)5-3-11)20-15-8-12(22)9-16(24)19(15)27-29(20)14-6-7-14;21-11-7-14-18(15(23)8-11)27-28(13-5-6-13)19(14)26-20-25-17(16(9-24)29-20)10-1-3-12(22)4-2-10;11-5-3-7-9(8(12)4-5)14-15(10(7)13)6-1-2-6;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;8-5-1-4(3-11)7(10)6(9)2-5;1-2-4-6-5-3-1;1-3(2)5-4;/h5-8,15-16,20H,9-14H2,1-4H3;2-5,8-9,14H,6-7H2,1H3;1-4,7-8,13H,5-6H2,(H,25,26);3-4,6H,1-2,13H2;1-4H;1-2H;6H,1-5H2;3,5H,4H2,1-2H3;1H
• InChIKey: MRPGWPFMTNFOEW-UHFFFAOYSA-N
• XLogP: 28.76
• TPSA: 369.18 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 31
• Rotatable Bonds: 16
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2472.87
LogP ≤ 5	28.76
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'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-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride?

The IUPAC name of 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride (CID 159799760) is 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride.

What is the SMILES notation for 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride?

The canonical SMILES for 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride is C1CCNCC1.CC(C)NN.CN(c1nc(-c2ccc(F)cc2)c(C#N)s1)c1c2cc(Br)cc(F)c2nn1C1CC1.CN(c1nc(-c2ccc(F)cc2)c(C#N)s1)c1c2cc(N3CCN(C(=O)OC(C)(C)C)CC3)cc(F)c2nn1C1CC1.Cl.N#Cc1cc(Br)cc(F)c1F.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.N#Cc1sc(Nc2c3cc(Br)cc(F)c3nn2C2CC2)nc1-c1ccc(F)cc1.Nc1c2cc(Br)cc(F)c2nn1C1CC1.

What is the InChIKey of 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride?

The InChIKey is MRPGWPFMTNFOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31F2N7O2S.C21H14BrF2N5S.C20H12BrF2N5S.C10H9BrFN3.C10H4ClFN2S.C7H2BrF2N.C5H11N.C3H10N2.ClH/c1-30(2,3)41-29(40)38-13-11-37(12-14-38)21-15-22-26(23(32)16-21)35-39(20-9-10-20)27(22)36(4)28-34-25(24(17-33)42-28)18-5-7-19(31)8-6-18;1-28(21-26-18(17(10-25)30-21)11-2-4-13(23)5-3-11)20-15-8-12(22)9-16(24)19(15)27-29(20)14-6-7-14;21-11-7-14-18(15(23)8-11)27-28(13-5-6-13)19(14)26-20-25-17(16(9-24)29-20)10-1-3-12(22)4-2-10;11-5-3-7-9(8(12)4-5)14-15(10(7)13)6-1-2-6;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;8-5-1-4(3-11)7(10)6(9)2-5;1-2-4-6-5-3-1;1-3(2)5-4;/h5-8,15-16,20H,9-14H2,1-4H3;2-5,8-9,14H,6-7H2,1H3;1-4,7-8,13H,5-6H2,(H,25,26);3-4,6H,1-2,13H2;1-4H;1-2H;6H,1-5H2;3,5H,4H2,1-2H3;1H.

What are the key properties of 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride?

5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride has a molecular weight of 2472.87 g/mol, XLogP of 28.76, 16 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-2-cyclopropyl-7-fluoroindazol-3-amine;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-cyclopropyl-7-fluoroindazol-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5-bromo-2,3-difluorobenzonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-cyclopropyl-7-fluoroindazol-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine;propan-2-ylhydrazine;hydrochloride is sourced from PubChem (CID 159799760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).