D159-0216 Screening compound: 1-(3,4-dimethoxyphenyl)-6,8-dimethyl-2-[(oxolan-2-yl)methyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

D159-0216 Screening compound: 1-(3,4-dimethoxyphenyl)-6,8-dimethyl-2-[(oxolan-2-yl)methyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
D159-0216 Screening compound: 1-(3,4-dimethoxyphenyl)-6,8-dimethyl-2-[(oxolan-2-yl)methyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D159-0216
1-(3,4-dimethoxyphenyl)-6,8-dimethyl-2-[(oxolan-2-yl)methyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-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

D159-0216

Molecular Formula

C26H27NO6 (C26 H27 NO6)

Compound Name

1-(3,4-dimethoxyphenyl)-6,8-dimethyl-2-[(oxolan-2-yl)methyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

1-(34-dimethoxyphenyl)-68-dimethyl-2-[(oxolan-2-yl)methyl]-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

Cc(cc1C)cc(OC2=C3C(c(cc4)cc(OC)c4OC)N(CC4OCCC4)C2=O)c1C3=O

InChI

InChI=1S/C26H27NO6/c1-14-10-15(2)21-20(11-14)33-25-22(24(21)28)23(16-7-8-18(30-3)19(12-16)31-4)27(26(25)29)13-17-6-5-9-32-17/h7-8,10-12,17,23H,5-6,9,13H2,1-4H3

InChI Key

JEZVNSWNWOPTES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07443592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.774

Distribution Coefficient, logD

3.774

Water Solubility, LogSw

-4.12

Polar Surface Area

60.648

Acid Dissociation Constant (pKa)

18.11

Base Dissociation Constant (pKb)

-4.57

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

38.50

D159-0216 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with D159-0216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D159-0216?
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What is the minimum amount of D159-0216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D159-0216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D159-0216
  • 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 D159-0216 available by request