5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide

C10H9BrClN3O4S — CID 82920902

IUPAC5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide
SMILESCc1nc(COc2c(Cl)cc(Br)cc2S(N)(=O)=O)no1
InChIInChI=1S/C10H9BrClN3O4S/c1-5-14-9(15-19-5)4-18-10-7(12)2-6(11)3-8(10)20(13,16)17/h2-3H,4H2,1H3,(H2,13,16,17)
InChIKeyWCNHEMRJKQXUIH-UHFFFAOYSA-N
MW382.62 g/mol
LogP2.02
Rot. Bonds4

About 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide

5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide (PubChem CID 82920902) has the molecular formula C10H9BrClN3O4S and a molecular weight of 382.62 g/mol. Its IUPAC name is 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide.

Molecular Properties

Compound Name5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide
PubChem CID82920902
Molecular FormulaC10H9BrClN3O4S
Molecular Weight382.62 g/mol
Exact Mass380.92
IUPAC Name5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide
SMILESCc1nc(COc2c(Cl)cc(Br)cc2S(N)(=O)=O)no1
InChIInChI=1S/C10H9BrClN3O4S/c1-5-14-9(15-19-5)4-18-10-7(12)2-6(11)3-8(10)20(13,16)17/h2-3H,4H2,1H3,(H2,13,16,17)
InChIKeyWCNHEMRJKQXUIH-UHFFFAOYSA-N
XLogP2.02
TPSA108.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.62
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide 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

2,3-dimethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide
CID 82922072
2,3,5-trimethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonyl chloride
CID 82911706
2-[3,5-dibromo-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 107739575
5-bromo-2-(2-bromoprop-2-enoxy)-3-chlorobenzenesulfonamide
CID 82921777
5-bromo-3-chloro-2-pentoxybenzenesulfonamide
CID 43164418
5-bromo-3-chloro-2-(3,3-dimethylbutoxy)benzenesulfonamide
CID 61481199
5-bromo-3-chloro-2-(2-fluoroethoxy)benzenesulfonamide
CID 80694291
5-bromo-3-chloro-2-(3-methylbutoxy)benzenesulfonamide
CID 43164414
5-bromo-3-chloro-2-(1,2,4-oxadiazol-3-ylmethoxy)benzenesulfonyl chloride
CID 82910206
5-bromo-3-chloro-2-(2,2,2-trifluoroethoxy)benzenesulfonamide
CID 43164412
2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide
CID 82920977
[3-bromo-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanamine
CID 63047206

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide?
The IUPAC name of 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide (CID 82920902) is 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide.
What is the SMILES notation for 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide?
The canonical SMILES for 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide is Cc1nc(COc2c(Cl)cc(Br)cc2S(N)(=O)=O)no1.
What is the InChIKey of 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide?
The InChIKey is WCNHEMRJKQXUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClN3O4S/c1-5-14-9(15-19-5)4-18-10-7(12)2-6(11)3-8(10)20(13,16)17/h2-3H,4H2,1H3,(H2,13,16,17).
What are the key properties of 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide?
5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide has a molecular weight of 382.62 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide is sourced from PubChem (CID 82920902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).