C987-0119 Screening compound: N-(3-chloro-4-fluorophenyl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide

C987-0119 Screening compound: N-(3-chloro-4-fluorophenyl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide
C987-0119 Screening compound: N-(3-chloro-4-fluorophenyl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C987-0119
N-(3-chloro-4-fluorophenyl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide

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

C987-0119

Molecular Formula

C25H24ClFN4O (C25 H24 ClFN4 O)

Compound Name

N-(3-chloro-4-fluorophenyl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-3-[346-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[34-b]pyridin-5-yl]propanamide

SMILES

Cc(c1c(C)c(CCC(Nc(cc2)cc(Cl)c2F)=O)c(C)nc11)nn1-c1ccc(C)cc1

InChI

InChI=1S/C25H24ClFN4O/c1-14-5-8-19(9-6-14)31-25-24(17(4)30-31)15(2)20(16(3)28-25)10-12-23(32)29-18-7-11-22(27)21(26)13-18/h5-9,11,13H,10,12H2,1-4H3,(H,29,32)

InChI Key

VOPGRQXLQHNZHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14809308

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.94

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.688

Distribution Coefficient, logD

5.657

Water Solubility, LogSw

-6.00

Polar Surface Area

47.089

Acid Dissociation Constant (pKa)

8.57

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with C987-0119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C987-0119?
Check Price and Availability of C987-0119, 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 C987-0119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C987-0119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C987-0119
  • 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 C987-0119 available by request