6-chloro-2-(4-chlorophenyl)-1-hydroxyindole

C14H9Cl2NO — CID 19895715

IUPAC6-chloro-2-(4-chlorophenyl)-1-hydroxyindole
SMILESOn1c(-c2ccc(Cl)cc2)cc2ccc(Cl)cc21
InChIInChI=1S/C14H9Cl2NO/c15-11-4-1-9(2-5-11)13-7-10-3-6-12(16)8-14(10)17(13)18/h1-8,18H
InChIKeyZZSKCMUKZIHRHW-UHFFFAOYSA-N
MW278.14 g/mol
LogP4.85
Rot. Bonds1

About 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole

6-chloro-2-(4-chlorophenyl)-1-hydroxyindole (PubChem CID 19895715) has the molecular formula C14H9Cl2NO and a molecular weight of 278.14 g/mol. Its IUPAC name is 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole.

Molecular Properties

Compound Name6-chloro-2-(4-chlorophenyl)-1-hydroxyindole
PubChem CID19895715
Molecular FormulaC14H9Cl2NO
Molecular Weight278.14 g/mol
Exact Mass277.01
IUPAC Name6-chloro-2-(4-chlorophenyl)-1-hydroxyindole
SMILESOn1c(-c2ccc(Cl)cc2)cc2ccc(Cl)cc21
InChIInChI=1S/C14H9Cl2NO/c15-11-4-1-9(2-5-11)13-7-10-3-6-12(16)8-14(10)17(13)18/h1-8,18H
InChIKeyZZSKCMUKZIHRHW-UHFFFAOYSA-N
XLogP4.85
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.14
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole?
The IUPAC name of 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole (CID 19895715) is 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole.
What is the SMILES notation for 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole?
The canonical SMILES for 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole is On1c(-c2ccc(Cl)cc2)cc2ccc(Cl)cc21.
What is the InChIKey of 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole?
The InChIKey is ZZSKCMUKZIHRHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2NO/c15-11-4-1-9(2-5-11)13-7-10-3-6-12(16)8-14(10)17(13)18/h1-8,18H.
What are the key properties of 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole?
6-chloro-2-(4-chlorophenyl)-1-hydroxyindole has a molecular weight of 278.14 g/mol, XLogP of 4.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-chlorophenyl)-1-hydroxyindole is sourced from PubChem (CID 19895715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).