5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide

C13H13BrN2O3S — CID 15943059

IUPAC5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
SMILESCOCCOc1ccc(Br)cc1C(=O)Nc1nccs1
InChIInChI=1S/C13H13BrN2O3S/c1-18-5-6-19-11-3-2-9(14)8-10(11)12(17)16-13-15-4-7-20-13/h2-4,7-8H,5-6H2,1H3,(H,15,16,17)
InChIKeyGSPBLARHYQSZAX-UHFFFAOYSA-N
MW357.23 g/mol
LogP3.18
Rot. Bonds6

About 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide

5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 15943059) has the molecular formula C13H13BrN2O3S and a molecular weight of 357.23 g/mol. Its IUPAC name is 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
PubChem CID15943059
Molecular FormulaC13H13BrN2O3S
Molecular Weight357.23 g/mol
Exact Mass355.98
IUPAC Name5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
SMILESCOCCOc1ccc(Br)cc1C(=O)Nc1nccs1
InChIInChI=1S/C13H13BrN2O3S/c1-18-5-6-19-11-3-2-9(14)8-10(11)12(17)16-13-15-4-7-20-13/h2-4,7-8H,5-6H2,1H3,(H,15,16,17)
InChIKeyGSPBLARHYQSZAX-UHFFFAOYSA-N
XLogP3.18
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.23
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide 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

5-bromo-2-ethoxy-N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361445
3-bromo-4-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 15943256
5-bromo-2-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 65307966
4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 86046967
N-(4-acetamidophenyl)-5-bromo-2-(2-methoxyethoxy)benzamide
CID 17357157
2-[[5-bromo-2-(2-methoxyethoxy)benzoyl]amino]benzoic acid
CID 54855912
5-bromo-2-(2-methoxyethoxy)-N-naphthalen-1-ylbenzamide
CID 17357158
2-(4-bromo-2-ethylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 19202117
3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide
CID 2083346
5-bromo-N-(3-chloro-4-methylphenyl)-2-(2-methoxyethoxy)benzamide
CID 17357254
4-butoxy-3-methoxy-N-(1,3-thiazol-2-yl)benzamide
CID 2666591
N'-benzoyl-5-bromo-2-(2-methoxyethoxy)benzohydrazide
CID 17357395

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide (CID 15943059) is 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide is COCCOc1ccc(Br)cc1C(=O)Nc1nccs1.
What is the InChIKey of 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is GSPBLARHYQSZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrN2O3S/c1-18-5-6-19-11-3-2-9(14)8-10(11)12(17)16-13-15-4-7-20-13/h2-4,7-8H,5-6H2,1H3,(H,15,16,17).
What are the key properties of 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 357.23 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 15943059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).