3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole

C22H13Br2N3 — CID 102596077

IUPAC3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole
SMILESBrc1cc(-c2ccccn2)c2[nH]c3c(-c4ccccn4)cc(Br)cc3c2c1
InChIInChI=1S/C22H13Br2N3/c23-13-9-15-16-10-14(24)12-18(20-6-2-4-8-26-20)22(16)27-21(15)17(11-13)19-5-1-3-7-25-19/h1-12,27H
InChIKeyNOHIJAROJALNNZ-UHFFFAOYSA-N
MW479.18 g/mol
LogP6.97
Rot. Bonds2

About 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole

3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole (PubChem CID 102596077) has the molecular formula C22H13Br2N3 and a molecular weight of 479.18 g/mol. Its IUPAC name is 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole.

Molecular Properties

Compound Name3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole
PubChem CID102596077
Molecular FormulaC22H13Br2N3
Molecular Weight479.18 g/mol
Exact Mass476.95
IUPAC Name3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole
SMILESBrc1cc(-c2ccccn2)c2[nH]c3c(-c4ccccn4)cc(Br)cc3c2c1
InChIInChI=1S/C22H13Br2N3/c23-13-9-15-16-10-14(24)12-18(20-6-2-4-8-26-20)22(16)27-21(15)17(11-13)19-5-1-3-7-25-19/h1-12,27H
InChIKeyNOHIJAROJALNNZ-UHFFFAOYSA-N
XLogP6.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.18
LogP ≤ 56.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole 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

3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
CID 140902302
1-pyridin-2-yl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
CID 164788747
3,6-ditert-butyl-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
CID 140902252
1-pyridin-2-yl-3,6-dipyridin-3-yl-8-(3-pyridin-2-ylphenyl)-9H-carbazole
CID 140902369
3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
CID 140902282
2-(5-pyridin-2-yl-1H-pyrrol-2-yl)pyridine;hydrochloride
CID 172801598
1-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]-8-pyridin-2-yl-9H-carbazole
CID 140902230
3,6-ditert-butyl-1-[6-(2H-isoindol-1-yl)-2-pyridinyl]-8-pyridin-2-yl-9H-carbazole
CID 140902473
1-imidazol-1-yl-8-pyridin-2-yl-9H-carbazole
CID 148903074
5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-pyridin-2-ylpyridine
CID 175125162
1,2-dipyridin-2-yl-9H-carbazole
CID 166099001
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406

Frequently Asked Questions

What is the IUPAC name of 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole?
The IUPAC name of 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole (CID 102596077) is 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole.
What is the SMILES notation for 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole?
The canonical SMILES for 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole is Brc1cc(-c2ccccn2)c2[nH]c3c(-c4ccccn4)cc(Br)cc3c2c1.
What is the InChIKey of 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole?
The InChIKey is NOHIJAROJALNNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13Br2N3/c23-13-9-15-16-10-14(24)12-18(20-6-2-4-8-26-20)22(16)27-21(15)17(11-13)19-5-1-3-7-25-19/h1-12,27H.
What are the key properties of 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole?
3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole has a molecular weight of 479.18 g/mol, XLogP of 6.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dibromo-1,8-dipyridin-2-yl-9H-carbazole is sourced from PubChem (CID 102596077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).