2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide

C16H12Cl2N2O2S — CID 11280072

IUPAC2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide
SMILESCc1ccc2cc(NS(=O)(=O)c3cc(Cl)ccc3Cl)ccc2n1
InChIInChI=1S/C16H12Cl2N2O2S/c1-10-2-3-11-8-13(5-7-15(11)19-10)20-23(21,22)16-9-12(17)4-6-14(16)18/h2-9,20H,1H3
InChIKeyWMIMKCBTHIMZMR-UHFFFAOYSA-N
MW367.26 g/mol
LogP4.65
Rot. Bonds3

About 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide

2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide (PubChem CID 11280072) has the molecular formula C16H12Cl2N2O2S and a molecular weight of 367.26 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide
PubChem CID11280072
Molecular FormulaC16H12Cl2N2O2S
Molecular Weight367.26 g/mol
Exact Mass366.00
IUPAC Name2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide
SMILESCc1ccc2cc(NS(=O)(=O)c3cc(Cl)ccc3Cl)ccc2n1
InChIInChI=1S/C16H12Cl2N2O2S/c1-10-2-3-11-8-13(5-7-15(11)19-10)20-23(21,22)16-9-12(17)4-6-14(16)18/h2-9,20H,1H3
InChIKeyWMIMKCBTHIMZMR-UHFFFAOYSA-N
XLogP4.65
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.26
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[3-[(2,5-dichlorophenyl)sulfonylamino]-4-methylphenyl]benzenesulfonamide
CID 4199762
2,5-dichloro-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
CID 7303996
6-[(2,5-dichlorophenyl)sulfonylamino]-1H-benzimidazol-2-olate
CID 2471823
2,5-dichloro-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
CID 2218577
2,5-dichloro-N-[4-(3-methylpyrazol-1-yl)phenyl]benzenesulfonamide
CID 35521098
2,5-dichloro-N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]benzenesulfonamide
CID 122297620
methyl 2-chloro-5-[(2,5-dichlorophenyl)sulfonylamino]benzoate
CID 40715475
2,5-dichloro-N-[4-[(3-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 989106
N-[3-chloro-4-(2-methylquinolin-6-yl)phenyl]-7-methyl-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
CID 167306517
2,5-dichloro-N-[4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]amino]phenyl]benzenesulfonamide
CID 121032391
2,5-dichloro-N-[3-methyl-4-(4-methyl-3-pyridinyl)phenyl]benzenesulfonamide
CID 66714005
4-[(2,5-dichlorophenyl)sulfonylamino]benzoic acid
CID 776763

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide?
The IUPAC name of 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide (CID 11280072) is 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide?
The canonical SMILES for 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide is Cc1ccc2cc(NS(=O)(=O)c3cc(Cl)ccc3Cl)ccc2n1.
What is the InChIKey of 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide?
The InChIKey is WMIMKCBTHIMZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2N2O2S/c1-10-2-3-11-8-13(5-7-15(11)19-10)20-23(21,22)16-9-12(17)4-6-14(16)18/h2-9,20H,1H3.
What are the key properties of 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide?
2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide has a molecular weight of 367.26 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-methylquinolin-6-yl)benzenesulfonamide is sourced from PubChem (CID 11280072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).