N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide

C19H14ClN3O3S — CID 23215879

IUPACN-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide
SMILESO=S(=O)(Nn1nc(-c2ccco2)cc1-c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C19H14ClN3O3S/c20-15-10-8-14(9-11-15)18-13-17(19-7-4-12-26-19)21-23(18)22-27(24,25)16-5-2-1-3-6-16/h1-13,22H
InChIKeyGABLAIHJXZDMQV-UHFFFAOYSA-N
MW399.86 g/mol
LogP4.40
Rot. Bonds5

About N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide

N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide (PubChem CID 23215879) has the molecular formula C19H14ClN3O3S and a molecular weight of 399.86 g/mol. Its IUPAC name is N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide.

Molecular Properties

Compound NameN-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide
PubChem CID23215879
Molecular FormulaC19H14ClN3O3S
Molecular Weight399.86 g/mol
Exact Mass399.04
IUPAC NameN-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide
SMILESO=S(=O)(Nn1nc(-c2ccco2)cc1-c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C19H14ClN3O3S/c20-15-10-8-14(9-11-15)18-13-17(19-7-4-12-26-19)21-23(18)22-27(24,25)16-5-2-1-3-6-16/h1-13,22H
InChIKeyGABLAIHJXZDMQV-UHFFFAOYSA-N
XLogP4.40
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.86
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-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

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide?
The IUPAC name of N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide (CID 23215879) is N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide.
What is the SMILES notation for N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide?
The canonical SMILES for N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide is O=S(=O)(Nn1nc(-c2ccco2)cc1-c1ccc(Cl)cc1)c1ccccc1.
What is the InChIKey of N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide?
The InChIKey is GABLAIHJXZDMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O3S/c20-15-10-8-14(9-11-15)18-13-17(19-7-4-12-26-19)21-23(18)22-27(24,25)16-5-2-1-3-6-16/h1-13,22H.
What are the key properties of N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide?
N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide has a molecular weight of 399.86 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-chlorophenyl)-3-(furan-2-yl)pyrazol-1-yl]benzenesulfonamide is sourced from PubChem (CID 23215879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).