4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole

C18H10Br2N2S2 — CID 51045264

IUPAC4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole
SMILESBrc1cccc(-c2csc(-c3ncc(-c4cccc(Br)c4)s3)n2)c1
InChIInChI=1S/C18H10Br2N2S2/c19-13-5-1-3-11(7-13)15-10-23-18(22-15)17-21-9-16(24-17)12-4-2-6-14(20)8-12/h1-10H
InChIKeySOYRYMALUOZTID-UHFFFAOYSA-N
MW478.23 g/mol
LogP7.13
Rot. Bonds3

About 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole

4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole (PubChem CID 51045264) has the molecular formula C18H10Br2N2S2 and a molecular weight of 478.23 g/mol. Its IUPAC name is 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole.

Molecular Properties

Compound Name4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole
PubChem CID51045264
Molecular FormulaC18H10Br2N2S2
Molecular Weight478.23 g/mol
Exact Mass475.87
IUPAC Name4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole
SMILESBrc1cccc(-c2csc(-c3ncc(-c4cccc(Br)c4)s3)n2)c1
InChIInChI=1S/C18H10Br2N2S2/c19-13-5-1-3-11(7-13)15-10-23-18(22-15)17-21-9-16(24-17)12-4-2-6-14(20)8-12/h1-10H
InChIKeySOYRYMALUOZTID-UHFFFAOYSA-N
XLogP7.13
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.23
LogP ≤ 57.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole 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

4-(3-bromophenyl)-2-(5-bromothiophen-2-yl)-1,3-thiazole
CID 79838979
4-(3-bromophenyl)-2-(4-bromophenyl)-1,3-thiazole
CID 78907524
4-(3-bromophenyl)-2-(3-methylphenyl)-1,3-thiazole
CID 78913074
4-(3-bromophenyl)-2-(2-methylphenyl)-1,3-thiazole
CID 78908720
4-(3-bromophenyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole
CID 78907532
4-(3-bromophenyl)-2-(1H-pyrrol-2-yl)-1,3-thiazole;hydrobromide
CID 137032183
4-(3-bromophenyl)-2-(4-ethyl-3-pyridinyl)-1,3-thiazole
CID 91360116
2-(3-bromophenyl)-4-(1H-pyrrol-2-yl)-1,3-thiazole
CID 78907588
4-(3-bromophenyl)-2-(2-methylfuran-3-yl)-1,3-thiazole
CID 113453495
2-(3-bromophenyl)-4-(1-methylpyrazol-4-yl)-1,3-thiazole
CID 79004047
2-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]-4-(3-methoxyphenyl)-1,3-thiazole
CID 46246000
1-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-methylpropan-2-amine
CID 116964967

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole?
The IUPAC name of 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole (CID 51045264) is 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole.
What is the SMILES notation for 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole?
The canonical SMILES for 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole is Brc1cccc(-c2csc(-c3ncc(-c4cccc(Br)c4)s3)n2)c1.
What is the InChIKey of 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole?
The InChIKey is SOYRYMALUOZTID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10Br2N2S2/c19-13-5-1-3-11(7-13)15-10-23-18(22-15)17-21-9-16(24-17)12-4-2-6-14(20)8-12/h1-10H.
What are the key properties of 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole?
4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole has a molecular weight of 478.23 g/mol, XLogP of 7.13, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromophenyl)-2-[5-(3-bromophenyl)-1,3-thiazol-2-yl]-1,3-thiazole is sourced from PubChem (CID 51045264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).