Y504-7553 Screening compound: 1-(4-chlorobenzyl)-6-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

Y504-7553 Screening compound: 1-(4-chlorobenzyl)-6-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
Y504-7553 Screening compound: 1-(4-chlorobenzyl)-6-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y504-7553
1-(4-chlorobenzyl)-6-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

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

Y504-7553

Molecular Formula

C20H17ClF3N5 (C20 H17 ClF3 N5)

Compound Name

1-(4-chlorobenzyl)-6-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

IUPAC name

4-{1-[(4-chlorophenyl)methyl]-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[34-b]pyridin-6-yl}-1-ethyl-1H-pyrazole

SMILES

CCn1ncc(-c2cc(C(F)(F)F)c(c(C)nn3Cc(cc4)ccc4Cl)c3n2)c1

InChI

InChI=1S/C20H17ClF3N5/c1-3-28-11-14(9-25-28)17-8-16(20(22,23)24)18-12(2)27-29(19(18)26-17)10-13-4-6-15(21)7-5-13/h4-9,11H,3,10H2,1-2H3

InChI Key

RAQBZJXOSBFYRC-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.84

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.718

Distribution Coefficient, logD

4.718

Water Solubility, LogSw

-4.91

Polar Surface Area

37.728

Acid Dissociation Constant (pKa)

24.89

Base Dissociation Constant (pKb)

2.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with Y504-7553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y504-7553?
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What is the minimum amount of Y504-7553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y504-7553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y504-7553
  • 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 Y504-7553 available by request