4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole

C104H103Cl8N23O5 — CID 159055763

IUPAC4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole
SMILESCC(Oc1ccc2[nH]nc(/C=C/c3cnc(CN4CCCCC4)cn3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3cnc(CN4CCCCC4)nc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3cncc(CN4CCOCC4)c3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ncc(CN4CCCCC4)cn3)c2c1)c1c(Cl)cncc1Cl
InChIInChI=1S/3C26H26Cl2N6O.C26H25Cl2N5O2/c1-17(26-22(27)14-29-15-23(26)28)35-20-6-8-25-21(11-20)24(32-33-25)7-5-18-12-31-19(13-30-18)16-34-9-3-2-4-10-34;1-17(26-21(27)14-29-15-22(26)28)35-19-6-8-24-20(11-19)23(32-33-24)7-5-18-12-30-25(31-13-18)16-34-9-3-2-4-10-34;1-17(26-21(27)14-29-15-22(26)28)35-19-5-6-23-20(11-19)24(33-32-23)7-8-25-30-12-18(13-31-25)16-34-9-3-2-4-10-34;1-17(26-22(27)14-30-15-23(26)28)35-20-3-5-25-21(11-20)24(31-32-25)4-2-18-10-19(13-29-12-18)16-33-6-8-34-9-7-33/h3*5-8,11-15,17H,2-4,9-10,16H2,1H3,(H,32,33);2-5,10-15,17H,6-9,16H2,1H3,(H,31,32)/b2*7-5+;8-7+;4-2+
InChIKeyJXVMXAFDRRJWBX-AYDIDLESSA-N
MW2038.75 g/mol
LogP24.86
Rot. Bonds28

About 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole

4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole (PubChem CID 159055763) has the molecular formula C104H103Cl8N23O5 and a molecular weight of 2038.75 g/mol. Its IUPAC name is 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole.

Molecular Properties

Compound Name4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole
PubChem CID159055763
Molecular FormulaC104H103Cl8N23O5
Molecular Weight2038.75 g/mol
Exact Mass2033.60
IUPAC Name4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole
SMILESCC(Oc1ccc2[nH]nc(/C=C/c3cnc(CN4CCCCC4)cn3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3cnc(CN4CCCCC4)nc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3cncc(CN4CCOCC4)c3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ncc(CN4CCCCC4)cn3)c2c1)c1c(Cl)cncc1Cl
InChIInChI=1S/3C26H26Cl2N6O.C26H25Cl2N5O2/c1-17(26-22(27)14-29-15-23(26)28)35-20-6-8-25-21(11-20)24(32-33-25)7-5-18-12-31-19(13-30-18)16-34-9-3-2-4-10-34;1-17(26-21(27)14-29-15-22(26)28)35-19-6-8-24-20(11-19)23(32-33-24)7-5-18-12-30-25(31-13-18)16-34-9-3-2-4-10-34;1-17(26-21(27)14-29-15-22(26)28)35-19-5-6-23-20(11-19)24(33-32-23)7-8-25-30-12-18(13-31-25)16-34-9-3-2-4-10-34;1-17(26-22(27)14-30-15-23(26)28)35-20-3-5-25-21(11-20)24(31-32-25)4-2-18-10-19(13-29-12-18)16-33-6-8-34-9-7-33/h3*5-8,11-15,17H,2-4,9-10,16H2,1H3,(H,32,33);2-5,10-15,17H,6-9,16H2,1H3,(H,31,32)/b2*7-5+;8-7+;4-2+
InChIKeyJXVMXAFDRRJWBX-AYDIDLESSA-N
XLogP24.86
TPSA315.62 Ų
H-Bond Donors4
H-Bond Acceptors24
Rotatable Bonds28
Heavy Atoms140
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002038.75
LogP ≤ 524.86
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1024

Analyze 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole?
The IUPAC name of 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole (CID 159055763) is 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole.
What is the SMILES notation for 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole?
The canonical SMILES for 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole is CC(Oc1ccc2[nH]nc(/C=C/c3cnc(CN4CCCCC4)cn3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3cnc(CN4CCCCC4)nc3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3cncc(CN4CCOCC4)c3)c2c1)c1c(Cl)cncc1Cl.CC(Oc1ccc2[nH]nc(/C=C/c3ncc(CN4CCCCC4)cn3)c2c1)c1c(Cl)cncc1Cl.
What is the InChIKey of 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole?
The InChIKey is JXVMXAFDRRJWBX-AYDIDLESSA-N. The full InChI is InChI=1S/3C26H26Cl2N6O.C26H25Cl2N5O2/c1-17(26-22(27)14-29-15-23(26)28)35-20-6-8-25-21(11-20)24(32-33-25)7-5-18-12-31-19(13-30-18)16-34-9-3-2-4-10-34;1-17(26-21(27)14-29-15-22(26)28)35-19-6-8-24-20(11-19)23(32-33-24)7-5-18-12-30-25(31-13-18)16-34-9-3-2-4-10-34;1-17(26-21(27)14-29-15-22(26)28)35-19-5-6-23-20(11-19)24(33-32-23)7-8-25-30-12-18(13-31-25)16-34-9-3-2-4-10-34;1-17(26-22(27)14-30-15-23(26)28)35-20-3-5-25-21(11-20)24(31-32-25)4-2-18-10-19(13-29-12-18)16-33-6-8-34-9-7-33/h3*5-8,11-15,17H,2-4,9-10,16H2,1H3,(H,32,33);2-5,10-15,17H,6-9,16H2,1H3,(H,31,32)/b2*7-5+;8-7+;4-2+.
What are the key properties of 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole?
4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole has a molecular weight of 2038.75 g/mol, XLogP of 24.86, 28 rotatable bonds, 4 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-[(E)-2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]ethenyl]-3-pyridinyl]methyl]morpholine;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrazin-2-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[2-(piperidin-1-ylmethyl)pyrimidin-5-yl]ethenyl]-1H-indazole;5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-3-[(E)-2-[5-(piperidin-1-ylmethyl)pyrimidin-2-yl]ethenyl]-1H-indazole is sourced from PubChem (CID 159055763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).