8563-0514 Screening compound: methyl 2-[3-(4-fluorophenyl)-2-methyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-5-yl]acetate

8563-0514 Screening compound: methyl 2-[3-(4-fluorophenyl)-2-methyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-5-yl]acetate
8563-0514 Screening compound: methyl 2-[3-(4-fluorophenyl)-2-methyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-5-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8563-0514
methyl 2-[3-(4-fluorophenyl)-2-methyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-5-yl]acetate

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

8563-0514

Molecular Formula

C16H14FN3O3 (C16 H14 FN3 O3)

Compound Name

methyl 2-[3-(4-fluorophenyl)-2-methyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidin-5-yl]acetate

IUPAC name

methyl 2-[3-(4-fluorophenyl)-2-methyl-7-oxo-4H7H-pyrazolo[15-a]pyrimidin-5-yl]acetate

SMILES

Cc(c(-c(cc1)ccc1F)c1NC(CC(OC)=O)=C2)nn1C2=O

InChI

InChI=1S/C16H14FN3O3/c1-9-15(10-3-5-11(17)6-4-10)16-18-12(8-14(22)23-2)7-13(21)20(16)19-9/h3-7,18H,8H2,1-2H3

InChI Key

MWCDPNJNZITHHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08088360

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.574

Distribution Coefficient, logD

1.318

Water Solubility, LogSw

-2.06

Polar Surface Area

59.387

Acid Dissociation Constant (pKa)

7.50

Base Dissociation Constant (pKb)

-3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8563-0514 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

BRD4 Targeted Library (4534 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8563-0514 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8563-0514?
Check Price and Availability of 8563-0514, 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 8563-0514 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8563-0514
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8563-0514
  • 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 8563-0514 available by request