0118-0244 Screening compound: 8,8-dimethyl-10-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,8H,9H,10H-pyrano[2,3-h]chromen-9-yl (2Z)-2-methylbut-2-enoate

0118-0244 Screening compound: 8,8-dimethyl-10-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,8H,9H,10H-pyrano[2,3-h]chromen-9-yl (2Z)-2-methylbut-2-enoate
0118-0244 Screening compound: 8,8-dimethyl-10-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,8H,9H,10H-pyrano[2,3-h]chromen-9-yl (2Z)-2-methylbut-2-enoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0118-0244
8,8-dimethyl-10-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,8H,9H,10H-pyrano[2,3-h]chromen-9-yl (2Z)-2-methylbut-2-enoate

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

0118-0244

Molecular Formula

C24H26O7 (C24 H26 O7)

Compound Name

8,8-dimethyl-10-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,8H,9H,10H-pyrano[2,3-h]chromen-9-yl (2Z)-2-methylbut-2-enoate

IUPAC name

(9R10R)-88-dimethyl-10-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H8H9H10H-pyrano[23-h]chromen-9-yl (2Z)-2-methylbut-2-enoate

SMILES

CC(C)([C@@H]([C@@H]1OC(/C(/C)=C/C)=O)OC(/C(/C)=C\C)=O)Oc(cc2)c1c(O1)c2C=CC1=O

InChI

InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/t20-,21+/m1/s1

InChI Key

PNTWXEIQXBRCPS-RTWAWAEBSA-N

MDL Number (MFCD)

MFCD01533689

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.919

Distribution Coefficient, logD

3.919

Water Solubility, LogSw

-4.13

Polar Surface Area

67.377

Acid Dissociation Constant (pKa)

26.78

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.50

0118-0244 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Natural Compounds Library (353 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0118-0244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0118-0244?
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What is the minimum amount of 0118-0244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0118-0244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0118-0244
  • 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 0118-0244 available by request