2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide

C17H14Cl2N2O2S — CID 16615086

IUPAC2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide
SMILESO=S(=O)(NCCc1cccc2cccnc12)c1cccc(Cl)c1Cl
InChIInChI=1S/C17H14Cl2N2O2S/c18-14-7-2-8-15(16(14)19)24(22,23)21-11-9-13-5-1-4-12-6-3-10-20-17(12)13/h1-8,10,21H,9,11H2
InChIKeyWFJWSFWMGYEEBG-UHFFFAOYSA-N
MW381.28 g/mol
LogP4.06
Rot. Bonds5

About 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide

2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide (PubChem CID 16615086) has the molecular formula C17H14Cl2N2O2S and a molecular weight of 381.28 g/mol. Its IUPAC name is 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide
PubChem CID16615086
Molecular FormulaC17H14Cl2N2O2S
Molecular Weight381.28 g/mol
Exact Mass380.02
IUPAC Name2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide
SMILESO=S(=O)(NCCc1cccc2cccnc12)c1cccc(Cl)c1Cl
InChIInChI=1S/C17H14Cl2N2O2S/c18-14-7-2-8-15(16(14)19)24(22,23)21-11-9-13-5-1-4-12-6-3-10-20-17(12)13/h1-8,10,21H,9,11H2
InChIKeyWFJWSFWMGYEEBG-UHFFFAOYSA-N
XLogP4.06
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.28
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dichloro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 47104213
2,5-dimethoxy-N-(2-quinolin-8-ylethyl)benzenesulfonamide
CID 18152497
5-bromo-2-ethoxy-N-(2-quinolin-8-ylethyl)benzenesulfonamide
CID 16615074
N-butylquinoline-8-sulfonamide
CID 2068304
N-(2,6-dichlorophenyl)quinoline-8-sulfonamide
CID 5068800
N-methyl-2-quinolin-8-ylethanamine
CID 62549686
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]quinoline-8-sulfonamide
CID 5228855
N-[2-(1H-imidazol-5-yl)ethyl]quinoline-8-sulfonamide
CID 4619893
6-chloro-N-(2-quinolin-8-ylethyl)pyridazin-3-amine
CID 112724616
3-chloro-2,2-dimethyl-N-(2-quinolin-8-ylethyl)propanamide
CID 81426799
2,3-dichloro-N-[(3-hydroxy-2-pyridinyl)methyl]benzenesulfonamide
CID 171697828
6-chloro-N-(2-quinolin-8-ylethyl)pyrazin-2-amine
CID 47151476

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide?
The IUPAC name of 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide (CID 16615086) is 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide is O=S(=O)(NCCc1cccc2cccnc12)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide?
The InChIKey is WFJWSFWMGYEEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N2O2S/c18-14-7-2-8-15(16(14)19)24(22,23)21-11-9-13-5-1-4-12-6-3-10-20-17(12)13/h1-8,10,21H,9,11H2.
What are the key properties of 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide?
2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide has a molecular weight of 381.28 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(2-quinolin-8-ylethyl)benzenesulfonamide is sourced from PubChem (CID 16615086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).