3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole

C18H10Cl2FN3 — CID 118448207

IUPAC3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole
SMILESFc1ccc(Cl)cc1-c1ncccc1-c1ccc2n[nH]c(Cl)c2c1
InChIInChI=1S/C18H10Cl2FN3/c19-11-4-5-15(21)13(9-11)17-12(2-1-7-22-17)10-3-6-16-14(8-10)18(20)24-23-16/h1-9H,(H,23,24)
InChIKeyWKFNAZLTJFPFCM-UHFFFAOYSA-N
MW358.20 g/mol
LogP5.74
Rot. Bonds2

About 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole

3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole (PubChem CID 118448207) has the molecular formula C18H10Cl2FN3 and a molecular weight of 358.20 g/mol. Its IUPAC name is 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole.

Molecular Properties

Compound Name3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole
PubChem CID118448207
Molecular FormulaC18H10Cl2FN3
Molecular Weight358.20 g/mol
Exact Mass357.02
IUPAC Name3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole
SMILESFc1ccc(Cl)cc1-c1ncccc1-c1ccc2n[nH]c(Cl)c2c1
InChIInChI=1S/C18H10Cl2FN3/c19-11-4-5-15(21)13(9-11)17-12(2-1-7-22-17)10-3-6-16-14(8-10)18(20)24-23-16/h1-9H,(H,23,24)
InChIKeyWKFNAZLTJFPFCM-UHFFFAOYSA-N
XLogP5.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.20
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole?
The IUPAC name of 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole (CID 118448207) is 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole.
What is the SMILES notation for 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole?
The canonical SMILES for 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole is Fc1ccc(Cl)cc1-c1ncccc1-c1ccc2n[nH]c(Cl)c2c1.
What is the InChIKey of 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole?
The InChIKey is WKFNAZLTJFPFCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10Cl2FN3/c19-11-4-5-15(21)13(9-11)17-12(2-1-7-22-17)10-3-6-16-14(8-10)18(20)24-23-16/h1-9H,(H,23,24).
What are the key properties of 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole?
3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole has a molecular weight of 358.20 g/mol, XLogP of 5.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2H-indazole is sourced from PubChem (CID 118448207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).