6872-1633 Screening compound: 1-(4-hydroxyphenyl)-2-(2-methoxyethyl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

6872-1633 Screening compound: 1-(4-hydroxyphenyl)-2-(2-methoxyethyl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
6872-1633 Screening compound: 1-(4-hydroxyphenyl)-2-(2-methoxyethyl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6872-1633
1-(4-hydroxyphenyl)-2-(2-methoxyethyl)-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

6872-1633

Molecular Formula

C20H17NO5 (C20 H17 NO5)

Compound Name

1-(4-hydroxyphenyl)-2-(2-methoxyethyl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

1-(4-hydroxyphenyl)-2-(2-methoxyethyl)-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

COCCN(C(C1=C2Oc(cccc3)c3C1=O)c(cc1)ccc1O)C2=O

InChI

InChI=1S/C20H17NO5/c1-25-11-10-21-17(12-6-8-13(22)9-7-12)16-18(23)14-4-2-3-5-15(14)26-19(16)20(21)24/h2-9,17,22H,10-11H2,1H3/t17-/m1/s1

InChI Key

MHMFWJWRTRAEDM-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD04447371

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.226

Distribution Coefficient, logD

2.225

Water Solubility, LogSw

-2.93

Polar Surface Area

62.942

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

-6.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

6872-1633 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6872-1633 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6872-1633?
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What is the minimum amount of 6872-1633 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6872-1633
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6872-1633
  • 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 6872-1633 available by request