bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole

C158H151Cl10N21O5 — CID 158237424

About bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole

bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole (PubChem CID 158237424) has the molecular formula C158H151Cl10N21O5 and a molecular weight of 2778.62 g/mol. Its IUPAC name is bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole.

Molecular Properties

• Compound Name: bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole
• PubChem CID: 158237424
• Molecular Formula: C158H151Cl10N21O5
• Molecular Weight: 2778.62 g/mol
• Exact Mass: 2771.91
• IUPAC Name: bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole
• SMILES: CC(Oc1ccc2[nH]nc(/C=C/c3ccc(CN(C)Cc4ccccc4)cc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ccc(CN4CCC(Cc5ccccc5)CC4)cc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ccc(CN4CCN(C)CC4)cc3)c2c1)c1c(Cl)cncc1Cl.CCN(Cc1ccccc1)Cc1ccc(/C=C/c2n[nH]c3ccc(OC(C)c4c(Cl)cncc4Cl)cc23)cc1.CCN(Cc1ccccc1)Cc1ccc(/C=C/c2n[nH]c3ccc(OC(C)c4c(Cl)cncc4Cl)cc23)cc1
• InChI: InChI=1S/C35H34Cl2N4O.2C32H30Cl2N4O.C31H28Cl2N4O.C28H29Cl2N5O/c1-24(35-31(36)21-38-22-32(35)37)42-29-12-14-34-30(20-29)33(39-40-34)13-11-25-7-9-28(10-8-25)23-41-17-15-27(16-18-41)19-26-5-3-2-4-6-26;2*1-3-38(20-24-7-5-4-6-8-24)21-25-11-9-23(10-12-25)13-15-30-27-17-26(14-16-31(27)37-36-30)39-22(2)32-28(33)18-35-19-29(32)34;1-21(31-27(32)17-34-18-28(31)33)38-25-13-15-30-26(16-25)29(35-36-30)14-12-22-8-10-24(11-9-22)20-37(2)19-23-6-4-3-5-7-23;1-19(28-24(29)16-31-17-25(28)30)36-22-8-10-27-23(15-22)26(32-33-27)9-7-20-3-5-21(6-4-20)18-35-13-11-34(2)12-14-35/h2-14,20-22,24,27H,15-19,23H2,1H3,(H,39,40);2*4-19,22H,3,20-21H2,1-2H3,(H,36,37);3-18,21H,19-20H2,1-2H3,(H,35,36);3-10,15-17,19H,11-14,18H2,1-2H3,(H,32,33)/b13-11+;2*15-13+;14-12+;9-7+
• InChIKey: GFDCWEXEGLIWKS-GVKQHMAJSA-N
• XLogP: 40.75
• TPSA: 273.44 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 21
• Rotatable Bonds: 45
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2778.62
LogP ≤ 5	40.75
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole?

The IUPAC name of bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole (CID 158237424) is bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole.

What is the SMILES notation for bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole?

The canonical SMILES for bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole is CC(Oc1ccc2[nH]nc(/C=C/c3ccc(CN(C)Cc4ccccc4)cc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ccc(CN4CCC(Cc5ccccc5)CC4)cc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ccc(CN4CCN(C)CC4)cc3)c2c1)c1c(Cl)cncc1Cl.CCN(Cc1ccccc1)Cc1ccc(/C=C/c2n[nH]c3ccc(OC(C)c4c(Cl)cncc4Cl)cc23)cc1.CCN(Cc1ccccc1)Cc1ccc(/C=C/c2n[nH]c3ccc(OC(C)c4c(Cl)cncc4Cl)cc23)cc1.

What is the InChIKey of bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole?

The InChIKey is GFDCWEXEGLIWKS-GVKQHMAJSA-N. The full InChI is InChI=1S/C35H34Cl2N4O.2C32H30Cl2N4O.C31H28Cl2N4O.C28H29Cl2N5O/c1-24(35-31(36)21-38-22-32(35)37)42-29-12-14-34-30(20-29)33(39-40-34)13-11-25-7-9-28(10-8-25)23-41-17-15-27(16-18-41)19-26-5-3-2-4-6-26;2*1-3-38(20-24-7-5-4-6-8-24)21-25-11-9-23(10-12-25)13-15-30-27-17-26(14-16-31(27)37-36-30)39-22(2)32-28(33)18-35-19-29(32)34;1-21(31-27(32)17-34-18-28(31)33)38-25-13-15-30-26(16-25)29(35-36-30)14-12-22-8-10-24(11-9-22)20-37(2)19-23-6-4-3-5-7-23;1-19(28-24(29)16-31-17-25(28)30)36-22-8-10-27-23(15-22)26(32-33-27)9-7-20-3-5-21(6-4-20)18-35-13-11-34(2)12-14-35/h2-14,20-22,24,27H,15-19,23H2,1H3,(H,39,40);2*4-19,22H,3,20-21H2,1-2H3,(H,36,37);3-18,21H,19-20H2,1-2H3,(H,35,36);3-10,15-17,19H,11-14,18H2,1-2H3,(H,32,33)/b13-11+;2*15-13+;14-12+;9-7+.

What are the key properties of bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole?

bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole has a molecular weight of 2778.62 g/mol, XLogP of 40.75, 45 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for bis(N-benzyl-N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]ethanamine);3-[(E)-2-[4-[(4-benzylpiperidin-1-yl)methyl]phenyl]ethenyl]-5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazole;N-[[4-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]phenyl]methyl]-N-methyl-1-phenylmethanamine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole is sourced from PubChem (CID 158237424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).