D730-0052 Screening compound: 1-(3,5-dimethylphenyl)-4-(2-ethoxyphenyl)-1H,2H,3H,4H,5H,7H-furo[3,4-b]pyridine-2,5-dione

D730-0052 Screening compound: 1-(3,5-dimethylphenyl)-4-(2-ethoxyphenyl)-1H,2H,3H,4H,5H,7H-furo[3,4-b]pyridine-2,5-dione
D730-0052 Screening compound: 1-(3,5-dimethylphenyl)-4-(2-ethoxyphenyl)-1H,2H,3H,4H,5H,7H-furo[3,4-b]pyridine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D730-0052
1-(3,5-dimethylphenyl)-4-(2-ethoxyphenyl)-1H,2H,3H,4H,5H,7H-furo[3,4-b]pyridine-2,5-dione

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

D730-0052

Molecular Formula

C23H23NO4 (C23 H23 NO4)

Compound Name

1-(3,5-dimethylphenyl)-4-(2-ethoxyphenyl)-1H,2H,3H,4H,5H,7H-furo[3,4-b]pyridine-2,5-dione

IUPAC name

1-(35-dimethylphenyl)-4-(2-ethoxyphenyl)-1H2H3H4H5H7H-furo[34-b]pyridine-25-dione

SMILES

CCOc1c(C(CC2=O)C(C(OC3)=O)=C3N2c2cc(C)cc(C)c2)cccc1

InChI

InChI=1S/C23H23NO4/c1-4-27-20-8-6-5-7-17(20)18-12-21(25)24(19-13-28-23(26)22(18)19)16-10-14(2)9-15(3)11-16/h5-11,18H,4,12-13H2,1-3H3/t18-/m0/s1

InChI Key

XWLNPJVMGDUZSO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD09659491

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.139

Distribution Coefficient, logD

4.139

Water Solubility, LogSw

-4.27

Polar Surface Area

45.200

Acid Dissociation Constant (pKa)

17.87

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with D730-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D730-0052?
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What is the minimum amount of D730-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D730-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D730-0052
  • 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 D730-0052 available by request