2774-0190 Screening compound: 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

2774-0190 Screening compound: 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)ethan-1-one
2774-0190 Screening compound: 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2774-0190
2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

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

2774-0190

Molecular Formula

C11H15N5O5 (C11 H15 N5 O5)

Compound Name

2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

IUPAC name

n/a

SMILES

Cc(n(CC(N1CCCCC1)=O)nc1[N+]([O-])=O)c1[N+]([O-])=O

InChI

InChI=1S/C11H15N5O5/c1-8-10(15(18)19)11(16(20)21)12-14(8)7-9(17)13-5-3-2-4-6-13/h2-7H2,1H3

InChI Key

GGNXKKOXNLHGAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00299868

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.27

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.509

Distribution Coefficient, logD

0.509

Water Solubility, LogSw

-0.40

Polar Surface Area

96.430

Acid Dissociation Constant (pKa)

25.22

Base Dissociation Constant (pKb)

0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.60

2774-0190 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2774-0190 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2774-0190?
Check Price and Availability of 2774-0190, 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 2774-0190 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2774-0190
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2774-0190
  • 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 2774-0190 available by request