Y501-5960 Screening compound: N-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide

Y501-5960 Screening compound: N-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide
Y501-5960 Screening compound: N-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-5960
N-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide

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

Y501-5960

Molecular Formula

C18H20ClF3N6O (C18 H20 ClF3 N6 O)

Compound Name

N-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-2-[3,6-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide

IUPAC name

N-[2-(4-chloro-35-dimethyl-1H-pyrazol-1-yl)ethyl]-2-[36-dimethyl-4-(trifluoromethyl)-1H-pyrazolo[34-b]pyridin-1-yl]acetamide

SMILES

Cc(n(CCNC(Cn1nc(C)c2c(C(F)(F)F)cc(C)nc12)=O)nc1C)c1Cl

InChI

InChI=1S/C18H20ClF3N6O/c1-9-7-13(18(20,21)22)15-10(2)25-28(17(15)24-9)8-14(29)23-5-6-27-12(4)16(19)11(3)26-27/h7H,5-6,8H2,1-4H3,(H,23,29)

InChI Key

WUPXJJRRANPKSV-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.942

Distribution Coefficient, logD

1.942

Water Solubility, LogSw

-3.49

Polar Surface Area

62.149

Acid Dissociation Constant (pKa)

14.64

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.44

References: we are preparing a list of scientific research reports with Y501-5960 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-5960?
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What is the minimum amount of Y501-5960 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-5960
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-5960
  • 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 Y501-5960 available by request