1496-1038 Screening compound: 2,4,8,10-tetramethyl-7-phenyl-7H-pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-5-ium

1496-1038 Screening compound: 2,4,8,10-tetramethyl-7-phenyl-7H-pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-5-ium
1496-1038 Screening compound: 2,4,8,10-tetramethyl-7-phenyl-7H-pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-5-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 1496-1038
2,4,8,10-tetramethyl-7-phenyl-7H-pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-5-ium

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

1496-1038

Molecular Formula

C19H19N4 (C19 H19 N4)

Compound Name

2,4,8,10-tetramethyl-7-phenyl-7H-pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-5-ium

IUPAC name

461113-tetramethyl-10-phenyl-37lambda5810-tetraazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35811-hexaen-7-ylium

SMILES

CC(C=C1C)=C2c3nc(C)cc(C)[n+]3N=C2N1c1ccccc1

InChI

InChI=1S/C19H19N4/c1-12-10-14(3)22(16-8-6-5-7-9-16)19-17(12)18-20-13(2)11-15(4)23(18)21-19/h5-11H,1-4H3/q+1

InChI Key

YHSBMHAJSLSYGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00695540

Chemical and Physical Properties

Saltdata

ClO4-

Molecular Weight

303.39

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.519

Distribution Coefficient, logD

3.519

Water Solubility, LogSw

-3.69

Polar Surface Area

22.001

Acid Dissociation Constant (pKa)

25.92

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

1496-1038 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1496-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1496-1038?
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What is the minimum amount of 1496-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1496-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1496-1038
  • 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 1496-1038 available by request