N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide

C15H12ClN3O2S — CID 159141337

IUPACN-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(-c2cnc3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C15H12ClN3O2S/c1-22(20,21)19-12-5-2-10(3-6-12)15-9-17-14-8-11(16)4-7-13(14)18-15/h2-9,19H,1H3
InChIKeyOVFNKCOUXIPTNU-UHFFFAOYSA-N
MW333.80 g/mol
LogP3.32
Rot. Bonds3

About N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide

N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide (PubChem CID 159141337) has the molecular formula C15H12ClN3O2S and a molecular weight of 333.80 g/mol. Its IUPAC name is N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide
PubChem CID159141337
Molecular FormulaC15H12ClN3O2S
Molecular Weight333.80 g/mol
Exact Mass333.03
IUPAC NameN-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(-c2cnc3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C15H12ClN3O2S/c1-22(20,21)19-12-5-2-10(3-6-12)15-9-17-14-8-11(16)4-7-13(14)18-15/h2-9,19H,1H3
InChIKeyOVFNKCOUXIPTNU-UHFFFAOYSA-N
XLogP3.32
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.80
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-chloro-2-phenylquinoxaline
CID 12631823
N-[5-(2,4-dichlorophenyl)-2-oxo-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-14-yl]methanesulfonamide
CID 15981176
5-chloro-2-fluoro-N-[4-(3-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)phenyl]benzenesulfonamide
CID 71537544
6-chloro-N-methylquinoxalin-2-amine
CID 119092444
N-[4-(6-bromo-4-phenylquinolin-2-yl)phenyl]methanesulfonamide
CID 1264811
6-chloro-2-propan-2-ylsulfonylquinoxaline
CID 70550712
6,7-dichloro-2-(4-methylphenyl)quinoxaline
CID 171478071
N-[4-[5-(5-chloro-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]methanesulfonamide
CID 135964979
3-(4-chlorophenyl)quinoxaline-6-carboxylic acid
CID 146673768
N-[4-(3H-benzimidazol-5-yl)phenyl]methanesulfonamide
CID 39819464
N-[3-chloro-4-[1-(4-chloro-3-quinoxalin-2-ylanilino)ethenyl]phenyl]methanesulfonamide
CID 67987235
6-chloro-2-(4-chlorophenyl)quinazoline
CID 57333326

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide?
The IUPAC name of N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide (CID 159141337) is N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide.
What is the SMILES notation for N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide?
The canonical SMILES for N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide is CS(=O)(=O)Nc1ccc(-c2cnc3cc(Cl)ccc3n2)cc1.
What is the InChIKey of N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide?
The InChIKey is OVFNKCOUXIPTNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2S/c1-22(20,21)19-12-5-2-10(3-6-12)15-9-17-14-8-11(16)4-7-13(14)18-15/h2-9,19H,1H3.
What are the key properties of N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide?
N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide has a molecular weight of 333.80 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-chloroquinoxalin-2-yl)phenyl]methanesulfonamide is sourced from PubChem (CID 159141337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).