4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide

C15H11BrN2O3S — CID 55826465

IUPAC4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1cccc(-c2cnco2)c1)c1ccc(Br)cc1
InChIInChI=1S/C15H11BrN2O3S/c16-12-4-6-14(7-5-12)22(19,20)18-13-3-1-2-11(8-13)15-9-17-10-21-15/h1-10,18H
InChIKeyJDKDAACPQHSFMZ-UHFFFAOYSA-N
MW379.24 g/mol
LogP3.90
Rot. Bonds4

About 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide

4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide (PubChem CID 55826465) has the molecular formula C15H11BrN2O3S and a molecular weight of 379.24 g/mol. Its IUPAC name is 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
PubChem CID55826465
Molecular FormulaC15H11BrN2O3S
Molecular Weight379.24 g/mol
Exact Mass377.97
IUPAC Name4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1cccc(-c2cnco2)c1)c1ccc(Br)cc1
InChIInChI=1S/C15H11BrN2O3S/c16-12-4-6-14(7-5-12)22(19,20)18-13-3-1-2-11(8-13)15-9-17-10-21-15/h1-10,18H
InChIKeyJDKDAACPQHSFMZ-UHFFFAOYSA-N
XLogP3.90
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.24
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]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

4-nitro-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
CID 58896227
N-[3-(1,3-oxazol-5-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 3733543
N-[3-(1,3-oxazol-5-yl)phenyl]-1H-pyrazole-5-sulfonamide
CID 102691965
N-[3-(1,3-oxazol-5-yl)phenyl]-2-(trifluoromethoxy)benzenesulfonamide
CID 3796264
(2R)-1-acetyl-2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]-2,3-dihydroindole-5-sulfonamide
CID 51963359
3,4-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
CID 2806355
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
4-bromo-N-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)phenyl]benzenesulfonamide
CID 90557039
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-bromobenzenesulfonamide
CID 100580950
4-bromo-N-[3-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)phenyl]benzenesulfonamide
CID 24663006
4-bromo-N-(3-pyrazin-2-yloxyphenyl)benzenesulfonamide
CID 31912208
N-[4-chloro-3-(1,3-oxazol-5-yl)phenyl]-4-methylbenzenesulfonamide
CID 169371933

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
The IUPAC name of 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide (CID 55826465) is 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide is O=S(=O)(Nc1cccc(-c2cnco2)c1)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
The InChIKey is JDKDAACPQHSFMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2O3S/c16-12-4-6-14(7-5-12)22(19,20)18-13-3-1-2-11(8-13)15-9-17-10-21-15/h1-10,18H.
What are the key properties of 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide has a molecular weight of 379.24 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 55826465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).