1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide

C22H20N2O3S — CID 17247797

IUPAC1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide
SMILESO=C(c1ccccc1)N1CCCc2cc(S(=O)(=O)Nc3ccccc3)ccc21
InChIInChI=1S/C22H20N2O3S/c25-22(17-8-3-1-4-9-17)24-15-7-10-18-16-20(13-14-21(18)24)28(26,27)23-19-11-5-2-6-12-19/h1-6,8-9,11-14,16,23H,7,10,15H2
InChIKeyTXUNSWUEEIOICD-UHFFFAOYSA-N
MW392.48 g/mol
LogP4.08
Rot. Bonds4

About 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide

1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide (PubChem CID 17247797) has the molecular formula C22H20N2O3S and a molecular weight of 392.48 g/mol. Its IUPAC name is 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide.

Molecular Properties

Compound Name1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide
PubChem CID17247797
Molecular FormulaC22H20N2O3S
Molecular Weight392.48 g/mol
Exact Mass392.12
IUPAC Name1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide
SMILESO=C(c1ccccc1)N1CCCc2cc(S(=O)(=O)Nc3ccccc3)ccc21
InChIInChI=1S/C22H20N2O3S/c25-22(17-8-3-1-4-9-17)24-15-7-10-18-16-20(13-14-21(18)24)28(26,27)23-19-11-5-2-6-12-19/h1-6,8-9,11-14,16,23H,7,10,15H2
InChIKeyTXUNSWUEEIOICD-UHFFFAOYSA-N
XLogP4.08
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-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

1-benzoyl-N-(3-bromophenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17247816
1-benzoyl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17247827
N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)-4-chlorobenzenesulfonamide
CID 27557632
1-(3-chlorobenzoyl)-N-(3-chlorophenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17248218
1-(4-fluorobenzoyl)-N-(4-phenoxyphenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17248136
1-benzoyl-N-(2-phenylethyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17247792
N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)-3,4-dimethoxybenzenesulfonamide
CID 27444717
1-benzoyl-N-(2-benzoyl-4-chlorophenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17247871
1-benzoyl-N-(2-methoxy-5-methylphenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17247836
1-(3-chlorobenzoyl)-N-(3,5-dichlorophenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17248230
1-(4-chlorobenzoyl)-N-(4-methylphenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17248002
N-(3-bromophenyl)-1-(4-fluorobenzoyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 17248119

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide?
The IUPAC name of 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide (CID 17247797) is 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide.
What is the SMILES notation for 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide?
The canonical SMILES for 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide is O=C(c1ccccc1)N1CCCc2cc(S(=O)(=O)Nc3ccccc3)ccc21.
What is the InChIKey of 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide?
The InChIKey is TXUNSWUEEIOICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3S/c25-22(17-8-3-1-4-9-17)24-15-7-10-18-16-20(13-14-21(18)24)28(26,27)23-19-11-5-2-6-12-19/h1-6,8-9,11-14,16,23H,7,10,15H2.
What are the key properties of 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide?
1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide has a molecular weight of 392.48 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-phenyl-3,4-dihydro-2H-quinoline-6-sulfonamide is sourced from PubChem (CID 17247797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).