C448-1509 Screening compound: 5-methyl-3-(4-methylphenyl)-1-(morpholine-4-carbonyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one

C448-1509 Screening compound: 5-methyl-3-(4-methylphenyl)-1-(morpholine-4-carbonyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one
C448-1509 Screening compound: 5-methyl-3-(4-methylphenyl)-1-(morpholine-4-carbonyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C448-1509
5-methyl-3-(4-methylphenyl)-1-(morpholine-4-carbonyl)-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

C448-1509

Molecular Formula

C23H22N4O3 (C23 H22 N4 O3)

Compound Name

5-methyl-3-(4-methylphenyl)-1-(morpholine-4-carbonyl)-3H,4H,5H-pyridazino[4,5-b]indol-4-one

IUPAC name

5-methyl-3-(4-methylphenyl)-1-(morpholine-4-carbonyl)-3H4H5H-pyridazino[45-b]indol-4-one

SMILES

Cc(cc1)ccc1N(C1=O)N=C(C(N2CCOCC2)=O)c2c1n(C)c1c2cccc1

InChI

InChI=1S/C23H22N4O3/c1-15-7-9-16(10-8-15)27-23(29)21-19(17-5-3-4-6-18(17)25(21)2)20(24-27)22(28)26-11-13-30-14-12-26/h3-10H,11-14H2,1-2H3

InChI Key

NBDKCMAYWNFRLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14759207

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.635

Distribution Coefficient, logD

2.635

Water Solubility, LogSw

-2.91

Polar Surface Area

52.528

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

C448-1509 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 C448-1509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C448-1509?
Check Price and Availability of C448-1509, 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 C448-1509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C448-1509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C448-1509
  • 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 C448-1509 available by request