Y030-8718 Screening compound: 2-bromo-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzamide

Y030-8718 Screening compound: 2-bromo-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzamide
Y030-8718 Screening compound: 2-bromo-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-8718
2-bromo-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzamide

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

Y030-8718

Molecular Formula

C14H16BrN3OS (C14 H16 BrN3 OS)

Compound Name

2-bromo-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzamide

IUPAC name

2-bromo-N-[5-(pentan-3-yl)-134-thiadiazol-2-yl]benzamide

SMILES

CCC(CC)c1nnc(NC(c(cccc2)c2Br)=O)s1

InChI

InChI=1S/C14H16BrN3OS/c1-3-9(4-2)13-17-18-14(20-13)16-12(19)10-7-5-6-8-11(10)15/h5-9H,3-4H2,1-2H3,(H,16,18,19)

InChI Key

GEBBKRZKFMNAFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03929672

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.328

Distribution Coefficient, logD

2.746

Water Solubility, LogSw

-4.30

Polar Surface Area

46.875

Acid Dissociation Constant (pKa)

5.83

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

Y030-8718 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y030-8718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-8718?
Check Price and Availability of Y030-8718, 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 Y030-8718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-8718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-8718
  • 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 Y030-8718 available by request