N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide

C18H12Cl2N4O2S — CID 3866993

IUPACN-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1cccc2cccnc12
InChIInChI=1S/C18H12Cl2N4O2S/c19-17-18(20)24(11-22-17)14-8-6-13(7-9-14)23-27(25,26)15-5-1-3-12-4-2-10-21-16(12)15/h1-11,23H
InChIKeyLNJSLLSBQLIFPC-UHFFFAOYSA-N
MW419.29 g/mol
LogP4.53
Rot. Bonds4

About N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide

N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide (PubChem CID 3866993) has the molecular formula C18H12Cl2N4O2S and a molecular weight of 419.29 g/mol. Its IUPAC name is N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide
PubChem CID3866993
Molecular FormulaC18H12Cl2N4O2S
Molecular Weight419.29 g/mol
Exact Mass418.01
IUPAC NameN-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1cccc2cccnc12
InChIInChI=1S/C18H12Cl2N4O2S/c19-17-18(20)24(11-22-17)14-8-6-13(7-9-14)23-27(25,26)15-5-1-3-12-4-2-10-21-16(12)15/h1-11,23H
InChIKeyLNJSLLSBQLIFPC-UHFFFAOYSA-N
XLogP4.53
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.29
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide 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-chloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3859357
2-bromo-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3276095
N-(4-formylphenyl)quinoline-8-sulfonamide
CID 121290762
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]pyridine-3-sulfonamide
CID 25036762
N-(4-bromophenyl)quinoline-8-sulfonamide
CID 3423367
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]-4-iodobenzenesulfonamide
CID 3277746
2,4-dichloro-N-[4-(4,5-dichloroimidazol-1-yl)phenyl]benzenesulfonamide
CID 3851178
N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]quinoline-8-sulfonamide
CID 5299496
N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
CID 2443922
N-[4-[(R)-methylsulfinyl]phenyl]quinoline-8-sulfonamide
CID 95781119
N-(2,6-dichlorophenyl)quinoline-8-sulfonamide
CID 5068800
N-methyl-N-[4-(quinolin-8-ylsulfonylamino)phenyl]acetamide
CID 22775261

Frequently Asked Questions

What is the IUPAC name of N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide?
The IUPAC name of N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide (CID 3866993) is N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide.
What is the SMILES notation for N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide?
The canonical SMILES for N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide is O=S(=O)(Nc1ccc(-n2cnc(Cl)c2Cl)cc1)c1cccc2cccnc12.
What is the InChIKey of N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide?
The InChIKey is LNJSLLSBQLIFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2N4O2S/c19-17-18(20)24(11-22-17)14-8-6-13(7-9-14)23-27(25,26)15-5-1-3-12-4-2-10-21-16(12)15/h1-11,23H.
What are the key properties of N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide?
N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide has a molecular weight of 419.29 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4,5-dichloroimidazol-1-yl)phenyl]quinoline-8-sulfonamide is sourced from PubChem (CID 3866993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).