D146-0240 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl}acetamide

D146-0240 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl}acetamide
D146-0240 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D146-0240
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl}acetamide

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

D146-0240

Molecular Formula

C25H23NO6 (C25 H23 NO6)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl}acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-{2359-tetramethyl-7-oxo-7H-furo[32-g]chromen-6-yl}acetamide

SMILES

Cc(c1c2)c(C)oc1c(C)c(O1)c2C(C)=C(CC(NCc(cc2)cc3c2OCO3)=O)C1=O

InChI

InChI=1S/C25H23NO6/c1-12-15(4)31-23-14(3)24-18(8-17(12)23)13(2)19(25(28)32-24)9-22(27)26-10-16-5-6-20-21(7-16)30-11-29-20/h5-8H,9-11H2,1-4H3,(H,26,27)

InChI Key

OFIKVIFYQCMFPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06439968

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.323

Distribution Coefficient, logD

4.323

Water Solubility, LogSw

-4.44

Polar Surface Area

70.340

Acid Dissociation Constant (pKa)

14.74

Base Dissociation Constant (pKb)

0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

D146-0240 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with D146-0240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D146-0240?
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What is the minimum amount of D146-0240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D146-0240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D146-0240
  • 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 D146-0240 available by request