M788-0896 Screening compound: 1-[2-(morpholin-4-yl)-2-oxoethyl]-4-phenyl-1H,2H,3H,4H,5H,7H-furo[3,4-d]pyrimidine-2,5-dione

M788-0896 Screening compound: 1-[2-(morpholin-4-yl)-2-oxoethyl]-4-phenyl-1H,2H,3H,4H,5H,7H-furo[3,4-d]pyrimidine-2,5-dione
M788-0896 Screening compound: 1-[2-(morpholin-4-yl)-2-oxoethyl]-4-phenyl-1H,2H,3H,4H,5H,7H-furo[3,4-d]pyrimidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound M788-0896
1-[2-(morpholin-4-yl)-2-oxoethyl]-4-phenyl-1H,2H,3H,4H,5H,7H-furo[3,4-d]pyrimidine-2,5-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

M788-0896

Molecular Formula

C18H19N3O5 (C18 H19 N3 O5)

Compound Name

1-[2-(morpholin-4-yl)-2-oxoethyl]-4-phenyl-1H,2H,3H,4H,5H,7H-furo[3,4-d]pyrimidine-2,5-dione

IUPAC name

1-[2-(morpholin-4-yl)-2-oxoethyl]-4-phenyl-1H2H3H4H5H7H-furo[34-d]pyrimidine-25-dione

SMILES

O=C(CN(C(CO1)=C(C(c2ccccc2)N2)C1=O)C2=O)N1CCOCC1

InChI

InChI=1S/C18H19N3O5/c22-14(20-6-8-25-9-7-20)10-21-13-11-26-17(23)15(13)16(19-18(21)24)12-4-2-1-3-5-12/h1-5,16H,6-11H2,(H,19,24)/t16-/m0/s1

InChI Key

RHRMVCHWXKCDPQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD28994456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.073

Distribution Coefficient, logD

0.072

Water Solubility, LogSw

-1.80

Polar Surface Area

74.692

Acid Dissociation Constant (pKa)

10.03

Base Dissociation Constant (pKb)

-1.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.90

M788-0896 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M788-0896 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M788-0896?
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What is the minimum amount of M788-0896 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M788-0896
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M788-0896
  • 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 M788-0896 available by request