2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide

C15H11Cl2N3O2S — CID 139191523

IUPAC2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1-n1cccn1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2N3O2S/c16-11-5-3-8-14(15(11)17)23(21,22)19-12-6-1-2-7-13(12)20-10-4-9-18-20/h1-10,19H
InChIKeyREWBZSPZNXVLGS-UHFFFAOYSA-N
MW368.25 g/mol
LogP3.98
Rot. Bonds4

About 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide

2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide (PubChem CID 139191523) has the molecular formula C15H11Cl2N3O2S and a molecular weight of 368.25 g/mol. Its IUPAC name is 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide
PubChem CID139191523
Molecular FormulaC15H11Cl2N3O2S
Molecular Weight368.25 g/mol
Exact Mass366.99
IUPAC Name2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1-n1cccn1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2N3O2S/c16-11-5-3-8-14(15(11)17)23(21,22)19-12-6-1-2-7-13(12)20-10-4-9-18-20/h1-10,19H
InChIKeyREWBZSPZNXVLGS-UHFFFAOYSA-N
XLogP3.98
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.25
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide?
The IUPAC name of 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide (CID 139191523) is 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1-n1cccn1)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide?
The InChIKey is REWBZSPZNXVLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O2S/c16-11-5-3-8-14(15(11)17)23(21,22)19-12-6-1-2-7-13(12)20-10-4-9-18-20/h1-10,19H.
What are the key properties of 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide?
2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide has a molecular weight of 368.25 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide is sourced from PubChem (CID 139191523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).