C660-0851 Screening compound: N-(2-chloro-4-fluorophenyl)-3,6-dimethyl-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

C660-0851 Screening compound: N-(2-chloro-4-fluorophenyl)-3,6-dimethyl-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide
C660-0851 Screening compound: N-(2-chloro-4-fluorophenyl)-3,6-dimethyl-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0851
N-(2-chloro-4-fluorophenyl)-3,6-dimethyl-4-oxo-3H,4H-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

C660-0851

Molecular Formula

C15H11ClFN3O3 (C15 H11 ClFN3 O3)

Compound Name

N-(2-chloro-4-fluorophenyl)-3,6-dimethyl-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

IUPAC name

N-(2-chloro-4-fluorophenyl)-36-dimethyl-4-oxo-3H4H-furo[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(Nc(ccc(F)c2)c2Cl)=O)c(C(N(C)C=N2)=O)c2o1

InChI

InChI=1S/C15H11ClFN3O3/c1-7-11(12-14(23-7)18-6-20(2)15(12)22)13(21)19-10-4-3-8(17)5-9(10)16/h3-6H,1-2H3,(H,19,21)

InChI Key

BJYPXMJAOKBSHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26965247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.815

Distribution Coefficient, logD

1.471

Water Solubility, LogSw

-3.01

Polar Surface Area

56.102

Acid Dissociation Constant (pKa)

7.32

Base Dissociation Constant (pKb)

-1.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

C660-0851 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

PI3K-Targeted Library (17255 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Kinases
  • GPCR

References: we are preparing a list of scientific research reports with C660-0851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0851?
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What is the minimum amount of C660-0851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0851
  • 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 C660-0851 available by request