N-benzo[h]quinolin-4-ylbenzenesulfonamide

C19H14N2O2S — CID 46307991

IUPACN-benzo[h]quinolin-4-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccnc2c1ccc1ccccc12)c1ccccc1
InChIInChI=1S/C19H14N2O2S/c22-24(23,15-7-2-1-3-8-15)21-18-12-13-20-19-16-9-5-4-6-14(16)10-11-17(18)19/h1-13H,(H,20,21)
InChIKeyZKMOLRTVWLTHNP-UHFFFAOYSA-N
MW334.40 g/mol
LogP4.19
Rot. Bonds3

About N-benzo[h]quinolin-4-ylbenzenesulfonamide

N-benzo[h]quinolin-4-ylbenzenesulfonamide (PubChem CID 46307991) has the molecular formula C19H14N2O2S and a molecular weight of 334.40 g/mol. Its IUPAC name is N-benzo[h]quinolin-4-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-benzo[h]quinolin-4-ylbenzenesulfonamide
PubChem CID46307991
Molecular FormulaC19H14N2O2S
Molecular Weight334.40 g/mol
Exact Mass334.08
IUPAC NameN-benzo[h]quinolin-4-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccnc2c1ccc1ccccc12)c1ccccc1
InChIInChI=1S/C19H14N2O2S/c22-24(23,15-7-2-1-3-8-15)21-18-12-13-20-19-16-9-5-4-6-14(16)10-11-17(18)19/h1-13H,(H,20,21)
InChIKeyZKMOLRTVWLTHNP-UHFFFAOYSA-N
XLogP4.19
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

N-benzo[h]quinolin-4-yl-2,5-dimethylbenzenesulfonamide
CID 46308022
N-(8-aminoquinolin-5-yl)benzenesulfonamide
CID 104826550
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
N-(1-isoquinolin-1-ylnaphthalen-2-yl)-4-methylbenzenesulfonamide
CID 72724173
N-[4-(benzo[b][1,10]phenanthrolin-7-ylamino)phenyl]benzenesulfonamide
CID 10050670
N-[4-[(2-methylbenzo[h]quinolin-4-yl)sulfamoyl]phenyl]acetamide
CID 46308052
N-(6-methoxyquinolin-8-yl)benzenesulfonamide
CID 821430
N-[1-[(2-hydroxynaphthalen-1-yl)methyl]naphthalen-2-yl]benzenesulfonamide
CID 163288574
N-(4-hydroxy-3-quinolin-8-ylsulfanylnaphthalen-1-yl)benzenesulfonamide
CID 1296368
4-chloro-N-(8-hydroxyquinolin-5-yl)benzenesulfonamide
CID 2318680
N-benzo[h]quinolin-4-ylpentanamide
CID 46307999
N-[5-(naphthalen-2-ylsulfonylamino)naphthalen-1-yl]naphthalene-2-sulfonamide
CID 3407912

Frequently Asked Questions

What is the IUPAC name of N-benzo[h]quinolin-4-ylbenzenesulfonamide?
The IUPAC name of N-benzo[h]quinolin-4-ylbenzenesulfonamide (CID 46307991) is N-benzo[h]quinolin-4-ylbenzenesulfonamide.
What is the SMILES notation for N-benzo[h]quinolin-4-ylbenzenesulfonamide?
The canonical SMILES for N-benzo[h]quinolin-4-ylbenzenesulfonamide is O=S(=O)(Nc1ccnc2c1ccc1ccccc12)c1ccccc1.
What is the InChIKey of N-benzo[h]quinolin-4-ylbenzenesulfonamide?
The InChIKey is ZKMOLRTVWLTHNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2S/c22-24(23,15-7-2-1-3-8-15)21-18-12-13-20-19-16-9-5-4-6-14(16)10-11-17(18)19/h1-13H,(H,20,21).
What are the key properties of N-benzo[h]quinolin-4-ylbenzenesulfonamide?
N-benzo[h]quinolin-4-ylbenzenesulfonamide has a molecular weight of 334.40 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzo[h]quinolin-4-ylbenzenesulfonamide is sourced from PubChem (CID 46307991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).