2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene

C20H12Br2 — CID 139178070

IUPAC2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene
SMILESBrc1ccc2cccc(-c3c(Br)ccc4ccccc34)c2c1
InChIInChI=1S/C20H12Br2/c21-15-10-8-14-5-3-7-17(18(14)12-15)20-16-6-2-1-4-13(16)9-11-19(20)22/h1-12H
InChIKeyUTLPXJFQOZCCPV-UHFFFAOYSA-N
MW412.12 g/mol
LogP7.18
Rot. Bonds1

About 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene

2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene (PubChem CID 139178070) has the molecular formula C20H12Br2 and a molecular weight of 412.12 g/mol. Its IUPAC name is 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene.

Molecular Properties

Compound Name2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene
PubChem CID139178070
Molecular FormulaC20H12Br2
Molecular Weight412.12 g/mol
Exact Mass409.93
IUPAC Name2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene
SMILESBrc1ccc2cccc(-c3c(Br)ccc4ccccc34)c2c1
InChIInChI=1S/C20H12Br2/c21-15-10-8-14-5-3-7-17(18(14)12-15)20-16-6-2-1-4-13(16)9-11-19(20)22/h1-12H
InChIKeyUTLPXJFQOZCCPV-UHFFFAOYSA-N
XLogP7.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.12
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene 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

2-bromo-1-naphthalen-1-ylnaphthalene
CID 620109
1-(2-bromonaphthalen-1-yl)acridine
CID 175119023
2-(2-bromonaphthalen-1-yl)phenol
CID 122642120
9-[3-(2-bromonaphthalen-1-yl)phenyl]-10-naphthalen-1-ylanthracene
CID 175622318
2,6-dibromo-1-(2-phenylphenyl)anthracene
CID 175140401
1-(2,5-dibromo-4-naphthalen-1-ylphenyl)naphthalene
CID 18454866
1-tetracen-5-yltetracene
CID 91610936
6-amino-3-bromo-2-naphthalen-1-ylphenol
CID 67804184
3-bromofluoranthene;8-bromofluoranthene
CID 174507222
1,2,7-tribromonaphthalene
CID 150191333
8-bromo-3-naphthalen-1-ylfluoranthene
CID 139499164
8-bromobenzo[a]anthracene-7,12-dione;4,8-dibromobenzo[a]anthracene-7,12-dione
CID 160743910

Frequently Asked Questions

What is the IUPAC name of 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene?
The IUPAC name of 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene (CID 139178070) is 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene.
What is the SMILES notation for 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene?
The canonical SMILES for 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene is Brc1ccc2cccc(-c3c(Br)ccc4ccccc34)c2c1.
What is the InChIKey of 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene?
The InChIKey is UTLPXJFQOZCCPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12Br2/c21-15-10-8-14-5-3-7-17(18(14)12-15)20-16-6-2-1-4-13(16)9-11-19(20)22/h1-12H.
What are the key properties of 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene?
2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene has a molecular weight of 412.12 g/mol, XLogP of 7.18, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-1-(7-bromonaphthalen-1-yl)naphthalene is sourced from PubChem (CID 139178070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).