8014-2403 Screening compound: 4-(3,4-dimethoxyphenyl)-5a,10,10-trihydroxy-1-isobutyl-5a,10-dihydro-1H-indeno[1',2':2,3]furo[3,4-b]pyrrole-2,3-dione

8014-2403 Screening compound: 4-(3,4-dimethoxyphenyl)-5a,10,10-trihydroxy-1-isobutyl-5a,10-dihydro-1H-indeno[1',2':2,3]furo[3,4-b]pyrrole-2,3-dione
8014-2403 Screening compound: 4-(3,4-dimethoxyphenyl)-5a,10,10-trihydroxy-1-isobutyl-5a,10-dihydro-1H-indeno[1',2':2,3]furo[3,4-b]pyrrole-2,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-2403
4-(3,4-dimethoxyphenyl)-5a,10,10-trihydroxy-1-isobutyl-5a,10-dihydro-1H-indeno[1',2':2,3]furo[3,4-b]pyrrole-2,3-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

8014-2403

Molecular Formula

C25H25NO8 (C25 H25 NO8)

Compound Name

4-(3,4-dimethoxyphenyl)-5a,10,10-trihydroxy-1-isobutyl-5a,10-dihydro-1H-indeno[1',2':2,3]furo[3,4-b]pyrrole-2,3-dione

IUPAC name

11-(34-dimethoxyphenyl)-229-trihydroxy-15-(2-methylpropyl)-10-oxa-15-azatetracyclo[7.6.0.0^{112}.0^{38}]pentadeca-3(8)4611-tetraene-1314-dione

SMILES

CC(C)CN(C1(C(c2c3cccc2)(O)O)C(C2=O)=C(c(cc4)cc(OC)c4OC)OC13O)C2=O

InChI

InChI=1S/C25H25NO8/c1-13(2)12-26-22(28)20(27)19-21(14-9-10-17(32-3)18(11-14)33-4)34-25(31)16-8-6-5-7-15(16)24(29,30)23(19,25)26/h5-11,13,29-31H,12H2,1-4H3

InChI Key

HIBCBSSMBPASHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03768328

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.508

Distribution Coefficient, logD

2.508

Water Solubility, LogSw

-2.88

Polar Surface Area

99.522

Acid Dissociation Constant (pKa)

13.87

Base Dissociation Constant (pKb)

-11.14

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with 8014-2403 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-2403?
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What is the minimum amount of 8014-2403 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-2403
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-2403
  • 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 8014-2403 available by request