C884-0324 Screening compound: 3-methyl-5-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-3H,4H,5H-pyridazino[4,5-b]indol-4-one

C884-0324 Screening compound: 3-methyl-5-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-3H,4H,5H-pyridazino[4,5-b]indol-4-one
C884-0324 Screening compound: 3-methyl-5-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-3H,4H,5H-pyridazino[4,5-b]indol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C884-0324
3-methyl-5-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-3H,4H,5H-pyridazino[4,5-b]indol-4-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

C884-0324

Molecular Formula

C20H25N5O2 (C20 H25 N5 O2)

Compound Name

3-methyl-5-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-3H,4H,5H-pyridazino[4,5-b]indol-4-one

IUPAC name

3-methyl-5-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-3H4H5H-pyridazino[45-b]indol-4-one

SMILES

CCCN(CC1)CCN1C(Cn1c(C(N(C)N=C2)=O)c2c2c1cccc2)=O

InChI

InChI=1S/C20H25N5O2/c1-3-8-23-9-11-24(12-10-23)18(26)14-25-17-7-5-4-6-15(17)16-13-21-22(2)20(27)19(16)25/h4-7,13H,3,8-12,14H2,1-2H3

InChI Key

NMERENWCITXFCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26966556

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.277

Distribution Coefficient, logD

1.095

Water Solubility, LogSw

-1.95

Polar Surface Area

49.205

Acid Dissociation Constant (pKa)

21.56

Base Dissociation Constant (pKb)

7.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

C884-0324 in Drug Discovery

Included in Screening Libraries

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

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C884-0324 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C884-0324?
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What is the minimum amount of C884-0324 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C884-0324
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C884-0324
  • 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 C884-0324 available by request