2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione

C14H6BrClN2O2 — CID 166096755

IUPAC2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione
SMILESO=c1c2cc(Br)ccc2n2c3c(Cl)cccc3c(=O)n12
InChIInChI=1S/C14H6BrClN2O2/c15-7-4-5-11-9(6-7)14(20)18-13(19)8-2-1-3-10(16)12(8)17(11)18/h1-6H
InChIKeyVSHRIZKITKJEBD-UHFFFAOYSA-N
MW349.57 g/mol
LogP2.92
Rot. Bonds

About 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione

2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione (PubChem CID 166096755) has the molecular formula C14H6BrClN2O2 and a molecular weight of 349.57 g/mol. Its IUPAC name is 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione.

Molecular Properties

Compound Name2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione
PubChem CID166096755
Molecular FormulaC14H6BrClN2O2
Molecular Weight349.57 g/mol
Exact Mass347.93
IUPAC Name2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione
SMILESO=c1c2cc(Br)ccc2n2c3c(Cl)cccc3c(=O)n12
InChIInChI=1S/C14H6BrClN2O2/c15-7-4-5-11-9(6-7)14(20)18-13(19)8-2-1-3-10(16)12(8)17(11)18/h1-6H
InChIKeyVSHRIZKITKJEBD-UHFFFAOYSA-N
XLogP2.92
TPSA42.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.57
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dibromo-8-chloroindazolo[1,2-a]indazole-10,12-dione
CID 167188268
3-bromo-5,6-diphenylcinnolino[2,1-b]phthalazine-8,13-dione
CID 132991804
2-bromo-5-(2-methylphenyl)phenanthridin-6-one
CID 146311346
10-bromo-4-chloro-6-isocyanoquinolino[2,1-b]quinazolin-12-one
CID 171606273
6-bromo-4-(2-chlorophenyl)-1-methylquinazolin-2-one
CID 4713933
4-[2-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-5-yl)-10,12-dioxoindazolo[1,2-a]indazol-6-yl]benzonitrile
CID 166096631
2-(2-bromo-5,6-dichloro-9-oxoacridin-10-yl)acetic acid
CID 138658101
6-bromo-3-[(2-chlorophenyl)methyl]quinazolin-4-one
CID 829638
6-bromo-3-(3-chlorophenyl)-1-[(3-methylphenyl)methyl]quinazoline-2,4-dione
CID 17190267
6-bromo-3-(3-chlorophenyl)-1H-quinazoline-2,4-dione
CID 1344529
6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one
CID 13357174
6-bromo-1-methylquinolin-4-one
CID 1377385

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione?
The IUPAC name of 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione (CID 166096755) is 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione.
What is the SMILES notation for 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione?
The canonical SMILES for 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione is O=c1c2cc(Br)ccc2n2c3c(Cl)cccc3c(=O)n12.
What is the InChIKey of 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione?
The InChIKey is VSHRIZKITKJEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H6BrClN2O2/c15-7-4-5-11-9(6-7)14(20)18-13(19)8-2-1-3-10(16)12(8)17(11)18/h1-6H.
What are the key properties of 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione?
2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione has a molecular weight of 349.57 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-chloroindazolo[1,2-a]indazole-10,12-dione is sourced from PubChem (CID 166096755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).