Y501-2948 Screening compound: 4,5-dibromo-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-thiophenecarboxamide

Y501-2948 Screening compound: 4,5-dibromo-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-thiophenecarboxamide
Y501-2948 Screening compound: 4,5-dibromo-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-thiophenecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-2948
4,5-dibromo-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-thiophenecarboxamide

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

Y501-2948

Molecular Formula

C17H14Br2ClN3OS (C17 H14 Br2 ClN3 OS)

Compound Name

4,5-dibromo-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-thiophenecarboxamide

IUPAC name

45-dibromo-N-{1-[(4-chlorophenyl)methyl]-35-dimethyl-1H-pyrazol-4-yl}thiophene-2-carboxamide

SMILES

Cc(n(Cc(cc1)ccc1Cl)nc1C)c1NC(c(s1)cc(Br)c1Br)=O

InChI

InChI=1S/C17H14Br2ClN3OS/c1-9-15(21-17(24)14-7-13(18)16(19)25-14)10(2)23(22-9)8-11-3-5-12(20)6-4-11/h3-7H,8H2,1-2H3,(H,21,24)

InChI Key

QTNQORCNPLZSQO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.64

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.535

Distribution Coefficient, logD

3.916

Water Solubility, LogSw

-4.65

Polar Surface Area

37.234

Acid Dissociation Constant (pKa)

6.90

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

References: we are preparing a list of scientific research reports with Y501-2948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-2948?
Check Price and Availability of Y501-2948, 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 Y501-2948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-2948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-2948
  • 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 Y501-2948 available by request