TSQ

CAT: 0127-BUP09775-01Size: 5 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-BUP09775-01Size:5 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

109628-27-5

Purity

=98%

Smiles

COc1cc(NS(=O)(=O)c2ccc(C)cc2)c2ncccc2c1

Chemical Information

N-(6-Methoxy-8-quinolinyl)-4-methylbenzenesulfonamide

CAS Number	109628-27-5
PubChem CID	130606
IUPAC Name	N-(6-methoxyquinolin-8-yl)-4-methylbenzenesulfonamide
Molecular Formula	C17H16N2O3S
Molecular Weight	328.4
XLogP	3
Topological Polar Surface Area	76.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	23
Formal Charge	0
Complexity	483

SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)OC)C=CC=N3

InChI

InChI=1S/C17H16N2O3S/c1-12-5-7-15(8-6-12)23(20,21)19-16-11-14(22-2)10-13-4-3-9-18-17(13)16/h3-11,19H,1-2H3

InChIKey

HKRNYOZJJMFDBV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109628-27-5

CID: 130606

Formula: C17H16N2O3S

MW: 328.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	328.4
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	328.08816355
Monoisotopic Mass	328.08816355
Topological Polar Surface Area	76.7 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	483
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
303-150	Riboclear (RNA Cleanup)
TBS10485-100	Tribio InVivoMAb Anti-Mouse TIGIT & PD-L1 Bispecific Antibody
TBS10191-1mg	Tetrahydrocannabinol (THC) Monoclonal Antibody
TBI3024-25MG	Ac-Leu-Leu-Nle-CHO (ALLN), Calpain inhibitor
122-101	ExgeneTM Forensic SV mini
TBS10483-100	Tribio InVivoMAb Anti-Mouse PD-L1 & CD28 Bispecific Antibody
TBS10183-1mg	Monoclonal Anti-Thyroid Stimulating Hormone (TSH) Antibody
TBS10340-0.5MG	InVivo Mouse IgG1 Isotype Control Antibody
121-220	Exfection Plasmid EF (Exdotoxin Free, Midi)
TBS10482-100	Tribio InVivoMAb Anti-Mouse PD-L1 & OX40 Bispecific Antibody