D299-0119 Screening compound: 5-chloro-N-[3-(3,4-difluorophenyl)-1,2-oxazol-5-yl]-3,6-dimethyl-1-benzofuran-2-carboxamide

D299-0119 Screening compound: 5-chloro-N-[3-(3,4-difluorophenyl)-1,2-oxazol-5-yl]-3,6-dimethyl-1-benzofuran-2-carboxamide
D299-0119 Screening compound: 5-chloro-N-[3-(3,4-difluorophenyl)-1,2-oxazol-5-yl]-3,6-dimethyl-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D299-0119
5-chloro-N-[3-(3,4-difluorophenyl)-1,2-oxazol-5-yl]-3,6-dimethyl-1-benzofuran-2-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

D299-0119

Molecular Formula

C20H13ClF2N2O3 (C20 H13 ClF2 N2 O3)

Compound Name

5-chloro-N-[3-(3,4-difluorophenyl)-1,2-oxazol-5-yl]-3,6-dimethyl-1-benzofuran-2-carboxamide

IUPAC name

5-chloro-N-[3-(34-difluorophenyl)-12-oxazol-5-yl]-36-dimethyl-1-benzofuran-2-carboxamide

SMILES

Cc(c1c2)c(C(Nc3cc(-c(cc4)cc(F)c4F)no3)=O)oc1cc(C)c2Cl

InChI

InChI=1S/C20H13ClF2N2O3/c1-9-5-17-12(7-13(9)21)10(2)19(27-17)20(26)24-18-8-16(25-28-18)11-3-4-14(22)15(23)6-11/h3-8H,1-2H3,(H,24,26)

InChI Key

JIMAMGUBMTUUDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08549395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.514

Distribution Coefficient, logD

6.504

Water Solubility, LogSw

-6.42

Polar Surface Area

54.136

Acid Dissociation Constant (pKa)

9.03

Base Dissociation Constant (pKb)

-5.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

D299-0119 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D299-0119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D299-0119?
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What is the minimum amount of D299-0119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D299-0119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D299-0119
  • 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 D299-0119 available by request