P950-0498 Screening compound: [2-(2-fluorophenyl)-6,7-dihydroimidazo[1,2-a]pyrimidin-8(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone

P950-0498 Screening compound: [2-(2-fluorophenyl)-6,7-dihydroimidazo[1,2-a]pyrimidin-8(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
P950-0498 Screening compound: [2-(2-fluorophenyl)-6,7-dihydroimidazo[1,2-a]pyrimidin-8(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound P950-0498
[2-(2-fluorophenyl)-6,7-dihydroimidazo[1,2-a]pyrimidin-8(5H)-yl](1-methyl-1H-pyrrol-2-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

P950-0498

Molecular Formula

C18H17FN4O (C18 H17 FN4 O)

Compound Name

[2-(2-fluorophenyl)-6,7-dihydroimidazo[1,2-a]pyrimidin-8(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone

IUPAC name

2-[2-(2-fluorophenyl)-5H6H7H8H-imidazo[12-a]pyrimidine-8-carbonyl]-1-methyl-1H-pyrrole

SMILES

Cn1c(C(N2c3nc(-c(cccc4)c4F)cn3CCC2)=O)ccc1

InChI

InChI=1S/C18H17FN4O/c1-21-9-4-8-16(21)17(24)23-11-5-10-22-12-15(20-18(22)23)13-6-2-3-7-14(13)19/h2-4,6-9,12H,5,10-11H2,1H3

InChI Key

ZZBFNDQPOXRLHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27616325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.460

Distribution Coefficient, logD

3.459

Water Solubility, LogSw

-3.54

Polar Surface Area

29.298

Acid Dissociation Constant (pKa)

22.99

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

P950-0498 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

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

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Neuropeptide S Library (2850 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P950-0498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P950-0498?
Check Price and Availability of P950-0498, 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 P950-0498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P950-0498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P950-0498
  • 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 P950-0498 available by request