C987-0076 Screening compound: N-(propan-2-yl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide

C987-0076 Screening compound: N-(propan-2-yl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide
C987-0076 Screening compound: N-(propan-2-yl)-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 C987-0076
N-(propan-2-yl)-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

C987-0076

Molecular Formula

C22H28N4O (C22 H28 N4 O)

Compound Name

N-(propan-2-yl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide

IUPAC name

N-(propan-2-yl)-3-[346-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[34-b]pyridin-5-yl]propanamide

SMILES

CC(C)NC(CCc1c(C)nc2n(-c3ccc(C)cc3)nc(C)c2c1C)=O

InChI

InChI=1S/C22H28N4O/c1-13(2)23-20(27)12-11-19-15(4)21-17(6)25-26(22(21)24-16(19)5)18-9-7-14(3)8-10-18/h7-10,13H,11-12H2,1-6H3,(H,23,27)

InChI Key

VMMOSZLTJFFEGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14809278

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.49

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

3.866

Distribution Coefficient, logD

3.864

Water Solubility, LogSw

-4.30

Polar Surface Area

47.657

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with C987-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C987-0076?
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What is the minimum amount of C987-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C987-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C987-0076
  • 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 C987-0076 available by request