tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide

C48H32Br8S2-4 — CID 173034951

IUPACtetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide
SMILESBrc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.[S-2].[S-2]
InChIInChI=1S/4C12H8Br2.2S/c4*13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10;;/h4*1-8H;;/q;;;;2*-2
InChIKeyOBGYQSRJHZUTMI-UHFFFAOYSA-N
MW1312.15 g/mol
LogP19.51
Rot. Bonds4

About tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide

tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide (PubChem CID 173034951) has the molecular formula C48H32Br8S2-4 and a molecular weight of 1312.15 g/mol. Its IUPAC name is tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide.

Molecular Properties

Compound Nametetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide
PubChem CID173034951
Molecular FormulaC48H32Br8S2-4
Molecular Weight1312.15 g/mol
Exact Mass1303.54
IUPAC Nametetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide
SMILESBrc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.[S-2].[S-2]
InChIInChI=1S/4C12H8Br2.2S/c4*13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10;;/h4*1-8H;;/q;;;;2*-2
InChIKeyOBGYQSRJHZUTMI-UHFFFAOYSA-N
XLogP19.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001312.15
LogP ≤ 519.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide 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

1-bromo-4-[4-[4-(4-bromophenyl)phenyl]phenyl]benzene
CID 59775505
1-bromo-4-[4-(4-chlorophenyl)phenyl]benzene
CID 151204294
azane;1,4-dibromobenzene
CID 175259215
1-(4-bromophenyl)-3-[4-[4-[3-(4-bromophenyl)-5-(4-phenylphenyl)phenyl]phenyl]phenyl]-5-(4-phenylphenyl)benzene
CID 102428633
[4-(4-bromophenyl)phenyl]-trimethylsilane
CID 15749307
1-bromo-4-(4-bromophenyl)benzene;[4-(4-bromophenyl)phenyl]boronic acid
CID 159137046
1-bromo-4-phenylbenzene;N-methylmethanamine
CID 66862098
1-bromo-4-(4-methyliodanuidylphenyl)benzene
CID 163836710
O-[4-(4-bromophenyl)phenyl]hydroxylamine
CID 71082038
[4-(4-bromophenyl)phenyl]methanol
CID 1393673
1-bromo-4-[4-(difluoromethyl)phenyl]benzene
CID 85090252
2,5-bis(4-bromophenyl)pyrimidine
CID 14089893

Frequently Asked Questions

What is the IUPAC name of tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide?
The IUPAC name of tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide (CID 173034951) is tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide.
What is the SMILES notation for tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide?
The canonical SMILES for tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide is Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.[S-2].[S-2].
What is the InChIKey of tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide?
The InChIKey is OBGYQSRJHZUTMI-UHFFFAOYSA-N. The full InChI is InChI=1S/4C12H8Br2.2S/c4*13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10;;/h4*1-8H;;/q;;;;2*-2.
What are the key properties of tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide?
tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide has a molecular weight of 1312.15 g/mol, XLogP of 19.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide is sourced from PubChem (CID 173034951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).