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ML329

CAT: 0931-T4028-05Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T4028-05Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19992-50-8
Target
TRP/TRPV Channel, Others
Related Pathways
Others, Membrane transporter/Ion channel
Purity
>99.99%
Bioactivity
ML329 is a small molecule inhibitor of MITF, inhibiting TRPM-1 promoter activity.
Smiles
NS(=O)(=O)c1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1
Molecular Formula
C16H12N2O4S
Molecular Weight
328.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-[(1,4-Dioxo-2-naphthalenyl)amino]benzenesulfonamide

4-[(1,4-dioxo-2-naphthalenyl)amino]benzenesulfonamide is a member of 1,4-naphthoquinones.

CAS Number19992-50-8
PubChem CID12387471
IUPAC Name4-[(1,4-dioxonaphthalen-2-yl)amino]benzenesulfonamide
Molecular FormulaC16H12N2O4S
Molecular Weight328.3
XLogP1.4
Topological Polar Surface Area115
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity627
SMILES
C1=CC=C2C(=C1)C(=O)C=C(C2=O)NC3=CC=C(C=C3)S(=O)(=O)N
InChI
InChI=1S/C16H12N2O4S/c17-23(21,22)11-7-5-10(6-8-11)18-14-9-15(19)12-3-1-2-4-13(12)16(14)20/h1-9,18H,(H2,17,21,22)
InChIKey
CSYFFQVEQXEIAB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-[(1,4-Dioxo-2-naphthalenyl)amino]benzenesulfonamide
CAS: 19992-50-8
CID: 12387471
Formula: C16H12N2O4S
MW: 328.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight328.3
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass328.05177804
Monoisotopic Mass328.05177804
Topological Polar Surface Area115 Ų
Heavy Atom Count23
Formal Charge0
Complexity627
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes