2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide

C18H17ClN2O3S — CID 173207565

IUPAC2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide
SMILESCCCc1onc(-c2ccc(Cl)cc2)c1-c1ccccc1S(N)(=O)=O
InChIInChI=1S/C18H17ClN2O3S/c1-2-5-15-17(14-6-3-4-7-16(14)25(20,22)23)18(21-24-15)12-8-10-13(19)11-9-12/h3-4,6-11H,2,5H2,1H3,(H2,20,22,23)
InChIKeyPWYXFDKIWIWIMY-UHFFFAOYSA-N
MW376.87 g/mol
LogP4.26
Rot. Bonds5

About 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide

2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide (PubChem CID 173207565) has the molecular formula C18H17ClN2O3S and a molecular weight of 376.87 g/mol. Its IUPAC name is 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide.

Molecular Properties

Compound Name2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide
PubChem CID173207565
Molecular FormulaC18H17ClN2O3S
Molecular Weight376.87 g/mol
Exact Mass376.06
IUPAC Name2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide
SMILESCCCc1onc(-c2ccc(Cl)cc2)c1-c1ccccc1S(N)(=O)=O
InChIInChI=1S/C18H17ClN2O3S/c1-2-5-15-17(14-6-3-4-7-16(14)25(20,22)23)18(21-24-15)12-8-10-13(19)11-9-12/h3-4,6-11H,2,5H2,1H3,(H2,20,22,23)
InChIKeyPWYXFDKIWIWIMY-UHFFFAOYSA-N
XLogP4.26
TPSA86.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.87
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]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-phenyl-5-propyl-1,2-oxazol-4-yl)benzenesulfonamide
CID 67594995
2-[3-(4-fluorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide
CID 173207014
bis(carbamothioic S-acid);2-[3-(4-fluorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide;methane;hydrate
CID 173207013
2-[2-(4-chlorophenyl)-5-propyl-3-pyridinyl]benzenesulfonamide
CID 173207449
4-[3-(3,4-dichlorophenyl)-4-(2-sulfamoylphenyl)-1,2-oxazol-5-yl]-N-hydroxybutanamide
CID 87973487
2-[5-[(2-hydroxy-2-methylpropoxy)methyl]-3-phenyl-1,2-oxazol-4-yl]benzenesulfonamide
CID 67594923
2-(5-methylsulfinyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonamide
CID 67594883
2-[4-(4-chlorophenyl)-1-ethyl-5-methylpyrazol-3-yl]benzenesulfonamide
CID 67646311
3-(4-chlorophenyl)-5-propyl-1,2-oxazole-4-carbonyl chloride
CID 139632551
3-[3-(4-chlorophenyl)-4-phenyl-1,2-oxazol-5-yl]propan-1-amine
CID 14023457
3-(4-chlorophenyl)-4-(2-sulfamoylphenyl)-1H-pyrazole-5-carboxamide
CID 67648774
2-[3-(3-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]benzenesulfonamide
CID 67560551

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide?
The IUPAC name of 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide (CID 173207565) is 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide.
What is the SMILES notation for 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide?
The canonical SMILES for 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide is CCCc1onc(-c2ccc(Cl)cc2)c1-c1ccccc1S(N)(=O)=O.
What is the InChIKey of 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide?
The InChIKey is PWYXFDKIWIWIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O3S/c1-2-5-15-17(14-6-3-4-7-16(14)25(20,22)23)18(21-24-15)12-8-10-13(19)11-9-12/h3-4,6-11H,2,5H2,1H3,(H2,20,22,23).
What are the key properties of 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide?
2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide has a molecular weight of 376.87 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-chlorophenyl)-5-propyl-1,2-oxazol-4-yl]benzenesulfonamide is sourced from PubChem (CID 173207565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).