C999-1235 Screening compound: N-(4-ethylphenyl)-3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]propanamide

C999-1235 Screening compound: N-(4-ethylphenyl)-3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]propanamide
C999-1235 Screening compound: N-(4-ethylphenyl)-3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C999-1235
N-(4-ethylphenyl)-3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-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

C999-1235

Molecular Formula

C26H28N4O2 (C26 H28 N4 O2)

Compound Name

N-(4-ethylphenyl)-3-[3-(2-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]propanamide

IUPAC name

N-(4-ethylphenyl)-3-[3-(2-methoxyphenyl)-46-dimethyl-1H-pyrazolo[34-b]pyridin-1-yl]propanamide

SMILES

CCc(cc1)ccc1NC(CCn(c1nc(C)cc(C)c11)nc1-c(cccc1)c1OC)=O

InChI

InChI=1S/C26H28N4O2/c1-5-19-10-12-20(13-11-19)28-23(31)14-15-30-26-24(17(2)16-18(3)27-26)25(29-30)21-8-6-7-9-22(21)32-4/h6-13,16H,5,14-15H2,1-4H3,(H,28,31)

InChI Key

YSOORMWMCGXWPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14810149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.945

Distribution Coefficient, logD

4.945

Water Solubility, LogSw

-4.73

Polar Surface Area

53.985

Acid Dissociation Constant (pKa)

12.19

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

C999-1235 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C999-1235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C999-1235?
Check Price and Availability of C999-1235, 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 C999-1235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C999-1235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C999-1235
  • 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 C999-1235 available by request