2-(3-bromophenyl)-4-methoxy-1,3-thiazole

C10H8BrNOS — CID 116891841

IUPAC2-(3-bromophenyl)-4-methoxy-1,3-thiazole
SMILESCOc1csc(-c2cccc(Br)c2)n1
InChIInChI=1S/C10H8BrNOS/c1-13-9-6-14-10(12-9)7-3-2-4-8(11)5-7/h2-6H,1H3
InChIKeyWSOYCXAOPNBVFU-UHFFFAOYSA-N
MW270.15 g/mol
LogP3.58
Rot. Bonds2

About 2-(3-bromophenyl)-4-methoxy-1,3-thiazole

2-(3-bromophenyl)-4-methoxy-1,3-thiazole (PubChem CID 116891841) has the molecular formula C10H8BrNOS and a molecular weight of 270.15 g/mol. Its IUPAC name is 2-(3-bromophenyl)-4-methoxy-1,3-thiazole.

Molecular Properties

Compound Name2-(3-bromophenyl)-4-methoxy-1,3-thiazole
PubChem CID116891841
Molecular FormulaC10H8BrNOS
Molecular Weight270.15 g/mol
Exact Mass268.95
IUPAC Name2-(3-bromophenyl)-4-methoxy-1,3-thiazole
SMILESCOc1csc(-c2cccc(Br)c2)n1
InChIInChI=1S/C10H8BrNOS/c1-13-9-6-14-10(12-9)7-3-2-4-8(11)5-7/h2-6H,1H3
InChIKeyWSOYCXAOPNBVFU-UHFFFAOYSA-N
XLogP3.58
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.15
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromophenyl)-4-(methoxymethyl)-1,3-thiazole
CID 107511692
4-(3-bromophenyl)-2-(3-methylphenyl)-1,3-thiazole
CID 78913074
2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]ethanethiol
CID 116889576
1-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-methylpropan-2-amine
CID 116888250
4-(3-bromophenyl)-2-(4-bromophenyl)-1,3-thiazole
CID 78907524
2-(1,3-benzodioxol-5-yl)-4-methoxy-1,3-thiazole
CID 116891760
2-[5-(3-bromophenyl)-4,6-dichloropyrimidin-2-yl]-4-methyl-1,3-thiazole
CID 104771000
2-(3-bromophenyl)-4-(1H-pyrrol-2-yl)-1,3-thiazole
CID 78907588
2-(3-bromophenyl)-4-(1-methylpyrazol-4-yl)-1,3-thiazole
CID 79004047
2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-3-methylbutan-1-ol
CID 116891373
methyl 2-[[2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]acetyl]-(2-methoxy-2-oxoethyl)amino]acetate
CID 56580499
5-(4-methoxy-1,3-thiazol-2-yl)-1,3-dihydrobenzimidazol-2-one
CID 116891819

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-4-methoxy-1,3-thiazole?
The IUPAC name of 2-(3-bromophenyl)-4-methoxy-1,3-thiazole (CID 116891841) is 2-(3-bromophenyl)-4-methoxy-1,3-thiazole.
What is the SMILES notation for 2-(3-bromophenyl)-4-methoxy-1,3-thiazole?
The canonical SMILES for 2-(3-bromophenyl)-4-methoxy-1,3-thiazole is COc1csc(-c2cccc(Br)c2)n1.
What is the InChIKey of 2-(3-bromophenyl)-4-methoxy-1,3-thiazole?
The InChIKey is WSOYCXAOPNBVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrNOS/c1-13-9-6-14-10(12-9)7-3-2-4-8(11)5-7/h2-6H,1H3.
What are the key properties of 2-(3-bromophenyl)-4-methoxy-1,3-thiazole?
2-(3-bromophenyl)-4-methoxy-1,3-thiazole has a molecular weight of 270.15 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-4-methoxy-1,3-thiazole is sourced from PubChem (CID 116891841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).