4153-0019 Screening compound: N'-[(E)-(1H-indol-3-yl)methylidene]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carbohydrazide

4153-0019 Screening compound: N'-[(E)-(1H-indol-3-yl)methylidene]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carbohydrazide
4153-0019 Screening compound: N'-[(E)-(1H-indol-3-yl)methylidene]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4153-0019
N'-[(E)-(1H-indol-3-yl)methylidene]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carbohydrazide

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

4153-0019

Molecular Formula

C20H18N6O3 (C20 H18 N6 O3)

Compound Name

N'-[(E)-(1H-indol-3-yl)methylidene]-1,3,7-trimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-carbohydrazide

IUPAC name

N'-[(E)-(1H-indol-3-yl)methylidene]-137-trimethyl-24-dioxo-1H2H3H4H-pyrido[23-d]pyrimidine-6-carbohydrazide

SMILES

Cc(c(C(N/N=C/c1c[nH]c2c1cccc2)=O)c1)nc(N(C)C(N2C)=O)c1C2=O

InChI

InChI=1S/C20H18N6O3/c1-11-14(8-15-17(23-11)25(2)20(29)26(3)19(15)28)18(27)24-22-10-12-9-21-16-7-5-4-6-13(12)16/h4-10,21H,1-3H3,(H,24,27)

InChI Key

FQPIVNCGHAPHRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00717266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.806

Distribution Coefficient, logD

2.393

Water Solubility, LogSw

-3.40

Polar Surface Area

87.004

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

4153-0019 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4153-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4153-0019?
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What is the minimum amount of 4153-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4153-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4153-0019
  • 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 4153-0019 available by request