C890-0029 Screening compound: 5,7-dimethyl-6-(2-morpholino-2-oxoethyl)-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one

C890-0029 Screening compound: 5,7-dimethyl-6-(2-morpholino-2-oxoethyl)-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
C890-0029 Screening compound: 5,7-dimethyl-6-(2-morpholino-2-oxoethyl)-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C890-0029
5,7-dimethyl-6-(2-morpholino-2-oxoethyl)-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one

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

C890-0029

Molecular Formula

C20H22N4O3 (C20 H22 N4 O3)

Compound Name

5,7-dimethyl-6-(2-morpholino-2-oxoethyl)-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one

IUPAC name

n/a

SMILES

Cc1c(C=NN(c2ccccc2)C2=O)c2c(C)n1CC(N1CCOCC1)=O

InChI

InChI=1S/C20H22N4O3/c1-14-17-12-21-24(16-6-4-3-5-7-16)20(26)19(17)15(2)23(14)13-18(25)22-8-10-27-11-9-22/h3-7,12H,8-11,13H2,1-2H3

InChI Key

WGWOQYAUFBAMNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14806267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.894

Distribution Coefficient, logD

0.894

Water Solubility, LogSw

-1.90

Polar Surface Area

52.809

Acid Dissociation Constant (pKa)

23.07

Base Dissociation Constant (pKb)

4.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

C890-0029 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C890-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C890-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C890-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C890-0029
  • 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 C890-0029 available by request