Y020-4199 Screening compound: 2-benzyl-8-[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl]-1H,2H,8H,9H-pyrido[4,3-b]1,6-naphthyridine-1,9-dione

Y020-4199 Screening compound: 2-benzyl-8-[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl]-1H,2H,8H,9H-pyrido[4,3-b]1,6-naphthyridine-1,9-dione
Y020-4199 Screening compound: 2-benzyl-8-[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl]-1H,2H,8H,9H-pyrido[4,3-b]1,6-naphthyridine-1,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-4199
2-benzyl-8-[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl]-1H,2H,8H,9H-pyrido[4,3-b]1,6-naphthyridine-1,9-dione

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

Y020-4199

Molecular Formula

C22H18N6O3 (C22 H18 N6 O3)

Compound Name

2-benzyl-8-[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl]-1H,2H,8H,9H-pyrido[4,3-b]1,6-naphthyridine-1,9-dione

IUPAC name

2-benzyl-8-[3-(methoxymethyl)-1H-124-triazol-5-yl]-1H2H8H9H-pyrido[43-b]16-naphthyridine-19-dione

SMILES

COCc1n[nH]c(N(C=Cc(nc2C=CN3Cc4ccccc4)c4cc2C3=O)C4=O)n1

InChI

InChI=1S/C22H18N6O3/c1-31-13-19-24-22(26-25-19)28-10-8-18-16(21(28)30)11-15-17(23-18)7-9-27(20(15)29)12-14-5-3-2-4-6-14/h2-11H,12-13H2,1H3,(H,24,25,26)

InChI Key

FGDKSTGSMYPLLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15198892

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.794

Distribution Coefficient, logD

1.791

Water Solubility, LogSw

-2.63

Polar Surface Area

84.693

Acid Dissociation Constant (pKa)

8.14

Base Dissociation Constant (pKb)

3.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

Y020-4199 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y020-4199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-4199?
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What is the minimum amount of Y020-4199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-4199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-4199
  • 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 Y020-4199 available by request