Y040-9166 Screening compound: N-cyclopropyl-1,3-dimethyl-6-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

Y040-9166 Screening compound: N-cyclopropyl-1,3-dimethyl-6-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Y040-9166 Screening compound: N-cyclopropyl-1,3-dimethyl-6-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-9166
N-cyclopropyl-1,3-dimethyl-6-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

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

Y040-9166

Molecular Formula

C15H20N4O (C15 H20 N4 O)

Compound Name

N-cyclopropyl-1,3-dimethyl-6-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

IUPAC name

N-cyclopropyl-13-dimethyl-6-(propan-2-yl)-1H-pyrazolo[34-b]pyridine-4-carboxamide

SMILES

CC(C)c1cc(C(NC2CC2)=O)c(c(C)nn2C)c2n1

InChI

InChI=1S/C15H20N4O/c1-8(2)12-7-11(15(20)16-10-5-6-10)13-9(3)18-19(4)14(13)17-12/h7-8,10H,5-6H2,1-4H3,(H,16,20)

InChI Key

QVZAYJZUGFSCMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10916032

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.147

Distribution Coefficient, logD

2.147

Water Solubility, LogSw

-2.72

Polar Surface Area

48.525

Acid Dissociation Constant (pKa)

12.30

Base Dissociation Constant (pKb)

3.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

Y040-9166 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y040-9166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-9166?
Check Price and Availability of Y040-9166, 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 Y040-9166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-9166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-9166
  • 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 Y040-9166 available by request