E948-0013 Screening compound: N-(3-chloro-4-fluorophenyl)-6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carboxamide

E948-0013 Screening compound: N-(3-chloro-4-fluorophenyl)-6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carboxamide
E948-0013 Screening compound: N-(3-chloro-4-fluorophenyl)-6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E948-0013
N-(3-chloro-4-fluorophenyl)-6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-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

E948-0013

Molecular Formula

C19H18ClFN4O2 (C19 H18 ClFN4 O2)

Compound Name

N-(3-chloro-4-fluorophenyl)-6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carboxamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-6-methyl-4-(piperidin-1-yl)furo[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(Nc(cc2)cc(Cl)c2F)=O)c2c(N3CCCCC3)ncnc2o1

InChI

InChI=1S/C19H18ClFN4O2/c1-11-15(18(26)24-12-5-6-14(21)13(20)9-12)16-17(22-10-23-19(16)27-11)25-7-3-2-4-8-25/h5-6,9-10H,2-4,7-8H2,1H3,(H,24,26)

InChI Key

IUQWEOIQYDCVGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14929685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.629

Distribution Coefficient, logD

4.623

Water Solubility, LogSw

-5.03

Polar Surface Area

54.646

Acid Dissociation Constant (pKa)

9.28

Base Dissociation Constant (pKb)

0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

E948-0013 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E948-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E948-0013?
Check Price and Availability of E948-0013, 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 E948-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E948-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E948-0013
  • 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 E948-0013 available by request