Y030-6951 Screening compound: 4-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzene-1-sulfonamide

Y030-6951 Screening compound: 4-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzene-1-sulfonamide
Y030-6951 Screening compound: 4-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6951
4-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzene-1-sulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y030-6951

Molecular Formula

C9H5BrF3N3O2S2 (C9 H5 BrF3 N3 O2 S2)

Compound Name

4-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzene-1-sulfonamide

IUPAC name

4-bromo-N-[5-(trifluoromethyl)-134-thiadiazol-2-yl]benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1Br)(Nc1nnc(C(F)(F)F)s1)=O

InChI

InChI=1S/C9H5BrF3N3O2S2/c10-5-1-3-6(4-2-5)20(17,18)16-8-15-14-7(19-8)9(11,12)13/h1-4H,(H,15,16)

InChI Key

VIWDEGWJZAJZNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03351744

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.19

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.443

Distribution Coefficient, logD

-2.638

Water Solubility, LogSw

-3.78

Polar Surface Area

64.433

Acid Dissociation Constant (pKa)

1.32

Base Dissociation Constant (pKb)

-5.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

Y030-6951 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y030-6951 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6951?
Check Price and Availability of Y030-6951, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y030-6951 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6951
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6951
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y030-6951 available by request