D103-1779 Screening compound: N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide

D103-1779 Screening compound: N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide
D103-1779 Screening compound: N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D103-1779
N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-6,8-dimethyl-4-oxo-4H-chromene-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

D103-1779

Molecular Formula

C28H22N2O6 (C28 H22 N2 O6)

Compound Name

N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide

IUPAC name

N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-68-dimethyl-4-oxo-4H-chromene-2-carboxamide

SMILES

Cc(cc1C)cc2c1OC(C(Nc1c(C(Nc(cc3)ccc3OC)=O)oc3c1cccc3)=O)=CC2=O

InChI

InChI=1S/C28H22N2O6/c1-15-12-16(2)25-20(13-15)21(31)14-23(36-25)27(32)30-24-19-6-4-5-7-22(19)35-26(24)28(33)29-17-8-10-18(34-3)11-9-17/h4-14H,1-3H3,(H,29,33)(H,30,32)

InChI Key

CZFVRQNKBXCCGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06601540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.264

Distribution Coefficient, logD

5.256

Water Solubility, LogSw

-5.33

Polar Surface Area

82.598

Acid Dissociation Constant (pKa)

9.13

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.70

D103-1779 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D103-1779 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D103-1779?
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What is the minimum amount of D103-1779 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D103-1779
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D103-1779
  • 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 D103-1779 available by request