4-bromo-3,7-dichloro-6-fluoro-2H-indazole

C7H2BrCl2FN2 — CID 154728676

IUPAC4-bromo-3,7-dichloro-6-fluoro-2H-indazole
SMILESFc1cc(Br)c2c(Cl)[nH]nc2c1Cl
InChIInChI=1S/C7H2BrCl2FN2/c8-2-1-3(11)5(9)6-4(2)7(10)13-12-6/h1H,(H,12,13)
InChIKeySUTACHOCCZODHM-UHFFFAOYSA-N
MW283.92 g/mol
LogP3.77
Rot. Bonds

About 4-bromo-3,7-dichloro-6-fluoro-2H-indazole

4-bromo-3,7-dichloro-6-fluoro-2H-indazole (PubChem CID 154728676) has the molecular formula C7H2BrCl2FN2 and a molecular weight of 283.92 g/mol. Its IUPAC name is 4-bromo-3,7-dichloro-6-fluoro-2H-indazole.

Molecular Properties

Compound Name4-bromo-3,7-dichloro-6-fluoro-2H-indazole
PubChem CID154728676
Molecular FormulaC7H2BrCl2FN2
Molecular Weight283.92 g/mol
Exact Mass281.88
IUPAC Name4-bromo-3,7-dichloro-6-fluoro-2H-indazole
SMILESFc1cc(Br)c2c(Cl)[nH]nc2c1Cl
InChIInChI=1S/C7H2BrCl2FN2/c8-2-1-3(11)5(9)6-4(2)7(10)13-12-6/h1H,(H,12,13)
InChIKeySUTACHOCCZODHM-UHFFFAOYSA-N
XLogP3.77
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.92
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 4-bromo-3,7-dichloro-6-fluoro-2H-indazole with MolForge

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

Launch Full Analysis

Related Compounds

3,4-dibromo-6-fluoro-7-methyl-2H-indazole
CID 171662324
1-bromo-3-chloro-2,4,5-trifluorobenzene
CID 14978107
3-bromo-2,6-dichloro-5-fluorobenzamide
CID 141400879
5-bromo-4,7-difluoro-2H-benzotriazole
CID 162757679
1-bromo-2-chloro-4,5-difluorobenzene
CID 2773255
1,4-dibromo-3-chloro-2,5-difluorobenzene
CID 118819170
3-bromo-4-chloro-5-fluoroaniline
CID 131585188
4-bromo-7-fluoro-3-methyl-2H-indazole
CID 118989920
6-bromo-2,4-dichloro-5,8-difluoroquinazoline
CID 176948856
7-bromo-4-chloro-5,8-difluoro-2-methylsulfanylquinazoline
CID 169181849
1-bromo-3-chloro-4,5-difluoro-2-iodobenzene
CID 53256791
6-bromo-4-chloro-5,8-difluoro-3-nitroquinoline
CID 107615385

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3,7-dichloro-6-fluoro-2H-indazole?
The IUPAC name of 4-bromo-3,7-dichloro-6-fluoro-2H-indazole (CID 154728676) is 4-bromo-3,7-dichloro-6-fluoro-2H-indazole.
What is the SMILES notation for 4-bromo-3,7-dichloro-6-fluoro-2H-indazole?
The canonical SMILES for 4-bromo-3,7-dichloro-6-fluoro-2H-indazole is Fc1cc(Br)c2c(Cl)[nH]nc2c1Cl.
What is the InChIKey of 4-bromo-3,7-dichloro-6-fluoro-2H-indazole?
The InChIKey is SUTACHOCCZODHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2BrCl2FN2/c8-2-1-3(11)5(9)6-4(2)7(10)13-12-6/h1H,(H,12,13).
What are the key properties of 4-bromo-3,7-dichloro-6-fluoro-2H-indazole?
4-bromo-3,7-dichloro-6-fluoro-2H-indazole has a molecular weight of 283.92 g/mol, XLogP of 3.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3,7-dichloro-6-fluoro-2H-indazole is sourced from PubChem (CID 154728676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).