5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol

C14H8Cl3N3O — CID 136867697

IUPAC5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol
SMILESOc1[nH]c2ccc(Cl)cc2c1/N=N/c1cccc(Cl)c1Cl
InChIInChI=1S/C14H8Cl3N3O/c15-7-4-5-10-8(6-7)13(14(21)18-10)20-19-11-3-1-2-9(16)12(11)17/h1-6,18,21H/b20-19+
InChIKeyZRAQXTOYSPEKLW-FMQUCBEESA-N
MW340.60 g/mol
LogP6.25
Rot. Bonds2

About 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol

5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol (PubChem CID 136867697) has the molecular formula C14H8Cl3N3O and a molecular weight of 340.60 g/mol. Its IUPAC name is 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol.

Molecular Properties

Compound Name5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol
PubChem CID136867697
Molecular FormulaC14H8Cl3N3O
Molecular Weight340.60 g/mol
Exact Mass338.97
IUPAC Name5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol
SMILESOc1[nH]c2ccc(Cl)cc2c1/N=N/c1cccc(Cl)c1Cl
InChIInChI=1S/C14H8Cl3N3O/c15-7-4-5-10-8(6-7)13(14(21)18-10)20-19-11-3-1-2-9(16)12(11)17/h1-6,18,21H/b20-19+
InChIKeyZRAQXTOYSPEKLW-FMQUCBEESA-N
XLogP6.25
TPSA60.74 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.60
LogP ≤ 56.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

3-[(5-chloro-2-methylphenyl)diazenyl]-1H-indol-2-ol
CID 136860025
3-[(4-chloro-2-methylphenyl)diazenyl]-5-fluoro-1H-indol-2-ol
CID 136867871
5-chloro-3-[(6-chloropyridazin-3-yl)diazenyl]-1H-indol-2-ol
CID 135983033
5-fluoro-3-[(2,4,6-trichlorophenyl)diazenyl]-1H-indol-2-ol
CID 135775190
N,N'-bis[(5-chloro-2-hydroxy-1H-indol-3-yl)imino]decanediamide
CID 4631655
5-bromo-3-[(7-chloroquinolin-4-yl)diazenyl]-1H-indol-2-ol
CID 3899987
3-[(5-chloro-2-methylphenyl)diazenyl]-7-methyl-1H-indol-2-ol
CID 136867576
N-[(5-chloro-2-hydroxy-1H-indol-3-yl)imino]-3-(dimethylamino)benzamide
CID 135982620
3-[(2,3-dichlorophenyl)iminomethyl]-5-fluoro-1H-indol-2-ol
CID 136996138
3-[(4-chlorophenyl)diazenyl]-5-(trifluoromethyl)-1H-indol-2-ol
CID 136867759
3-chloro-N-[(5-fluoro-2-hydroxy-1H-indol-3-yl)imino]benzamide
CID 135784571
N-[(5-chloro-2-hydroxy-1H-indol-3-yl)imino]-4-propan-2-ylbenzenesulfonamide
CID 135647686

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol?
The IUPAC name of 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol (CID 136867697) is 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol.
What is the SMILES notation for 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol?
The canonical SMILES for 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol is Oc1[nH]c2ccc(Cl)cc2c1/N=N/c1cccc(Cl)c1Cl.
What is the InChIKey of 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol?
The InChIKey is ZRAQXTOYSPEKLW-FMQUCBEESA-N. The full InChI is InChI=1S/C14H8Cl3N3O/c15-7-4-5-10-8(6-7)13(14(21)18-10)20-19-11-3-1-2-9(16)12(11)17/h1-6,18,21H/b20-19+.
What are the key properties of 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol?
5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol has a molecular weight of 340.60 g/mol, XLogP of 6.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[(2,3-dichlorophenyl)diazenyl]-1H-indol-2-ol is sourced from PubChem (CID 136867697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).