3-(4-chlorophenyl)-2-(4-methylphenyl)indazole

C20H15ClN2 — CID 102171716

IUPAC3-(4-chlorophenyl)-2-(4-methylphenyl)indazole
SMILESCc1ccc(-n2nc3ccccc3c2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C20H15ClN2/c1-14-6-12-17(13-7-14)23-20(15-8-10-16(21)11-9-15)18-4-2-3-5-19(18)22-23/h2-13H,1H3
InChIKeyLWDZORNGOGDPDF-UHFFFAOYSA-N
MW318.81 g/mol
LogP5.65
Rot. Bonds2

About 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole

3-(4-chlorophenyl)-2-(4-methylphenyl)indazole (PubChem CID 102171716) has the molecular formula C20H15ClN2 and a molecular weight of 318.81 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole.

Molecular Properties

Compound Name3-(4-chlorophenyl)-2-(4-methylphenyl)indazole
PubChem CID102171716
Molecular FormulaC20H15ClN2
Molecular Weight318.81 g/mol
Exact Mass318.09
IUPAC Name3-(4-chlorophenyl)-2-(4-methylphenyl)indazole
SMILESCc1ccc(-n2nc3ccccc3c2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C20H15ClN2/c1-14-6-12-17(13-7-14)23-20(15-8-10-16(21)11-9-15)18-4-2-3-5-19(18)22-23/h2-13H,1H3
InChIKeyLWDZORNGOGDPDF-UHFFFAOYSA-N
XLogP5.65
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.81
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-(4-methylphenyl)-3-phenylindazole
CID 177414447
1-(4-chlorophenyl)-3-(4-methylphenyl)-5-phenylpyrazole-4-carboxylic acid
CID 4988708
2,6-dimethyl-4-(3-phenylindazol-2-yl)phenol
CID 102113609
3-(4-chlorophenyl)-1-(4-methylphenyl)pyrazole
CID 23524520
5-(4-chlorophenyl)-4-(4-methylphenyl)sulfonyl-1,3-diphenylpyrazole
CID 15359150
1,5-bis(4-chlorophenyl)-4-methylpyrazole-3-carboxylic acid
CID 66641410
4-(chloromethyl)-5-(4-chlorophenyl)-1-(4-methylphenyl)triazole
CID 56769724
5-(4-chlorophenyl)-1-(4-methylphenyl)triazole-4-carbaldehyde
CID 82199167
4-chloro-3,5-bis(3-methylphenyl)-1-(4-methylphenyl)pyrazole
CID 19587079
5-(4-chlorophenyl)-3-(difluoromethyl)-1-(4-methylphenyl)pyrazole
CID 143036335
(4-chlorophenyl)-(2-phenylindazol-3-yl)methanone
CID 71481537
5-(4-chlorophenyl)-3-methyl-1-phenyl-1,2,4-triazole
CID 13163603

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole?
The IUPAC name of 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole (CID 102171716) is 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole.
What is the SMILES notation for 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole?
The canonical SMILES for 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole is Cc1ccc(-n2nc3ccccc3c2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole?
The InChIKey is LWDZORNGOGDPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN2/c1-14-6-12-17(13-7-14)23-20(15-8-10-16(21)11-9-15)18-4-2-3-5-19(18)22-23/h2-13H,1H3.
What are the key properties of 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole?
3-(4-chlorophenyl)-2-(4-methylphenyl)indazole has a molecular weight of 318.81 g/mol, XLogP of 5.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-2-(4-methylphenyl)indazole is sourced from PubChem (CID 102171716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).