Y041-7247 Screening compound: 1-(6-bromo-1H-indazol-3-yl)-5-oxo-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide

Y041-7247 Screening compound: 1-(6-bromo-1H-indazol-3-yl)-5-oxo-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide
Y041-7247 Screening compound: 1-(6-bromo-1H-indazol-3-yl)-5-oxo-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-7247
1-(6-bromo-1H-indazol-3-yl)-5-oxo-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide

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

Y041-7247

Molecular Formula

C17H16BrN5O2S (C17 H16 BrN5 O2 S)

Compound Name

1-(6-bromo-1H-indazol-3-yl)-5-oxo-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide

IUPAC name

1-(6-bromo-1H-indazol-3-yl)-5-oxo-N-[2-(13-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide

SMILES

O=C(C(CC1=O)CN1c1n[nH]c2c1ccc(Br)c2)NCCc1nccs1

InChI

InChI=1S/C17H16BrN5O2S/c18-11-1-2-12-13(8-11)21-22-16(12)23-9-10(7-15(23)24)17(25)20-4-3-14-19-5-6-26-14/h1-2,5-6,8,10H,3-4,7,9H2,(H,20,25)(H,21,22)/t10-/m1/s1

InChI Key

OVWHHFCRNYESKM-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD23138453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.144

Distribution Coefficient, logD

2.144

Water Solubility, LogSw

-2.91

Polar Surface Area

74.585

Acid Dissociation Constant (pKa)

12.33

Base Dissociation Constant (pKb)

2.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.41

Y041-7247 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with Y041-7247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-7247?
Check Price and Availability of Y041-7247, 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 Y041-7247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-7247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-7247
  • 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 Y041-7247 available by request