L489-1971 Screening compound: N-(3-cyanophenyl)-2-{6,7-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}acetamide

L489-1971 Screening compound: N-(3-cyanophenyl)-2-{6,7-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}acetamide
L489-1971 Screening compound: N-(3-cyanophenyl)-2-{6,7-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L489-1971
N-(3-cyanophenyl)-2-{6,7-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}acetamide

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

L489-1971

Molecular Formula

C23H22N4O2 (C23 H22 N4 O2)

Compound Name

N-(3-cyanophenyl)-2-{6,7-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}acetamide

IUPAC name

N-(3-cyanophenyl)-2-{67-dimethyl-10-oxo-1H2H3H4H5H10H-benzo[b]16-naphthyridin-2-yl}acetamide

SMILES

Cc(cc1)c(C)c(NC2=C3CN(CC(Nc4cc(C#N)ccc4)=O)CC2)c1C3=O

InChI

InChI=1S/C23H22N4O2/c1-14-6-7-18-22(15(14)2)26-20-8-9-27(12-19(20)23(18)29)13-21(28)25-17-5-3-4-16(10-17)11-24/h3-7,10H,8-9,12-13H2,1-2H3,(H,25,28)(H,26,29)

InChI Key

BSRYHFQEWAUDBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27642321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.941

Distribution Coefficient, logD

3.916

Water Solubility, LogSw

-3.96

Polar Surface Area

65.867

Acid Dissociation Constant (pKa)

8.62

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

L489-1971 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L489-1971 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L489-1971?
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What is the minimum amount of L489-1971 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L489-1971
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L489-1971
  • 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 L489-1971 available by request