C884-0988 Screening compound: 2-{4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-(propan-2-yl)propanamide

C884-0988 Screening compound: 2-{4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-(propan-2-yl)propanamide
C884-0988 Screening compound: 2-{4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-(propan-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C884-0988
2-{4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-(propan-2-yl)propanamide

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

C884-0988

Molecular Formula

C16H18N4O2 (C16 H18 N4 O2)

Compound Name

2-{4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-(propan-2-yl)propanamide

IUPAC name

2-{4-oxo-3H4H5H-pyridazino[45-b]indol-5-yl}-N-(propan-2-yl)propanamide

SMILES

CC(C)NC(C(C)n1c(C(NN=C2)=O)c2c2c1cccc2)=O

InChI

InChI=1S/C16H18N4O2/c1-9(2)18-15(21)10(3)20-13-7-5-4-6-11(13)12-8-17-19-16(22)14(12)20/h4-10H,1-3H3,(H,18,21)(H,19,22)/t10-/m0/s1

InChI Key

IGJNZTSFSXHCSC-JTQLQIEISA-N

MDL Number (MFCD)

MFCD26966761

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.049

Distribution Coefficient, logD

2.049

Water Solubility, LogSw

-2.53

Polar Surface Area

63.708

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

3.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

C884-0988 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

DGK Inhibitors Library (10558 compounds)

Fragments Library (11262 compounds)

PI3K-Targeted Library (17255 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
  • Kinases
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with C884-0988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C884-0988?
Check Price and Availability of C884-0988, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C884-0988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C884-0988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C884-0988
  • 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 C884-0988 available by request