C883-0029 Screening compound: morpholino[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone

C883-0029 Screening compound: morpholino[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
C883-0029 Screening compound: morpholino[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C883-0029
morpholino[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone

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

C883-0029

Molecular Formula

C18H18N4O2 (C18 H18 N4 O2)

Compound Name

morpholino[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone

IUPAC name

4-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]morpholine

SMILES

O=C(c1c(-n2cccc2)n(-c2ccccc2)nc1)N1CCOCC1

InChI

InChI=1S/C18H18N4O2/c23-18(21-10-12-24-13-11-21)16-14-19-22(15-6-2-1-3-7-15)17(16)20-8-4-5-9-20/h1-9,14H,10-13H2

InChI Key

AJNJSBUFKQGTGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13756280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.442

Distribution Coefficient, logD

2.442

Water Solubility, LogSw

-2.70

Polar Surface Area

41.652

Acid Dissociation Constant (pKa)

27.82

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

C883-0029 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with C883-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C883-0029?
Check Price and Availability of C883-0029, 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 C883-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C883-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C883-0029
  • 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 C883-0029 available by request