M816-1144 Screening compound: 1-(3-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl}propanoyl)piperidine-4-carboxamide

M816-1144 Screening compound: 1-(3-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl}propanoyl)piperidine-4-carboxamide
M816-1144 Screening compound: 1-(3-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl}propanoyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M816-1144
1-(3-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl}propanoyl)piperidine-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

M816-1144

Molecular Formula

C21H23N5O3 (C21 H23 N5 O3)

Compound Name

1-(3-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl}propanoyl)piperidine-4-carboxamide

IUPAC name

1-(3-{4-oxo-2-phenyl-4H5H-pyrazolo[15-a]pyrazin-5-yl}propanoyl)piperidine-4-carboxamide

SMILES

NC(C(CC1)CCN1C(CCN(C=Cn(c1c2)nc2-c2ccccc2)C1=O)=O)=O

InChI

InChI=1S/C21H23N5O3/c22-20(28)16-6-9-24(10-7-16)19(27)8-11-25-12-13-26-18(21(25)29)14-17(23-26)15-4-2-1-3-5-15/h1-5,12-14,16H,6-11H2,(H2,22,28)

InChI Key

DOJUGGMTEFQEGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27555112

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.033

Distribution Coefficient, logD

0.033

Water Solubility, LogSw

-1.52

Polar Surface Area

78.400

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M816-1144 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with M816-1144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M816-1144?
Check Price and Availability of M816-1144, 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 M816-1144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M816-1144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M816-1144
  • 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 M816-1144 available by request