N-(2,6-dichlorophenyl)quinoline-8-sulfonamide

C15H10Cl2N2O2S — CID 5068800

IUPACN-(2,6-dichlorophenyl)quinoline-8-sulfonamide
SMILESO=S(=O)(Nc1c(Cl)cccc1Cl)c1cccc2cccnc12
InChIInChI=1S/C15H10Cl2N2O2S/c16-11-6-2-7-12(17)15(11)19-22(20,21)13-8-1-4-10-5-3-9-18-14(10)13/h1-9,19H
InChIKeyVJBWEWZPPJYDQR-UHFFFAOYSA-N
MW353.23 g/mol
LogP4.34
Rot. Bonds3

About N-(2,6-dichlorophenyl)quinoline-8-sulfonamide

N-(2,6-dichlorophenyl)quinoline-8-sulfonamide (PubChem CID 5068800) has the molecular formula C15H10Cl2N2O2S and a molecular weight of 353.23 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)quinoline-8-sulfonamide
PubChem CID5068800
Molecular FormulaC15H10Cl2N2O2S
Molecular Weight353.23 g/mol
Exact Mass351.98
IUPAC NameN-(2,6-dichlorophenyl)quinoline-8-sulfonamide
SMILESO=S(=O)(Nc1c(Cl)cccc1Cl)c1cccc2cccnc12
InChIInChI=1S/C15H10Cl2N2O2S/c16-11-6-2-7-12(17)15(11)19-22(20,21)13-8-1-4-10-5-3-9-18-14(10)13/h1-9,19H
InChIKeyVJBWEWZPPJYDQR-UHFFFAOYSA-N
XLogP4.34
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.23
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)quinoline-8-sulfonamide?
The IUPAC name of N-(2,6-dichlorophenyl)quinoline-8-sulfonamide (CID 5068800) is N-(2,6-dichlorophenyl)quinoline-8-sulfonamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)quinoline-8-sulfonamide?
The canonical SMILES for N-(2,6-dichlorophenyl)quinoline-8-sulfonamide is O=S(=O)(Nc1c(Cl)cccc1Cl)c1cccc2cccnc12.
What is the InChIKey of N-(2,6-dichlorophenyl)quinoline-8-sulfonamide?
The InChIKey is VJBWEWZPPJYDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O2S/c16-11-6-2-7-12(17)15(11)19-22(20,21)13-8-1-4-10-5-3-9-18-14(10)13/h1-9,19H.
What are the key properties of N-(2,6-dichlorophenyl)quinoline-8-sulfonamide?
N-(2,6-dichlorophenyl)quinoline-8-sulfonamide has a molecular weight of 353.23 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)quinoline-8-sulfonamide is sourced from PubChem (CID 5068800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).