8020-3088 Screening compound: 2-{4-[(1E)-1-(3,4-dimethoxyphenyl)prop-1-en-2-yl]-6-phenyl-1,3,5-triazin-2-yl}phenol

8020-3088 Screening compound: 2-{4-[(1E)-1-(3,4-dimethoxyphenyl)prop-1-en-2-yl]-6-phenyl-1,3,5-triazin-2-yl}phenol
8020-3088 Screening compound: 2-{4-[(1E)-1-(3,4-dimethoxyphenyl)prop-1-en-2-yl]-6-phenyl-1,3,5-triazin-2-yl}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-3088
2-{4-[(1E)-1-(3,4-dimethoxyphenyl)prop-1-en-2-yl]-6-phenyl-1,3,5-triazin-2-yl}phenol

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

8020-3088

Molecular Formula

C26H23N3O3 (C26 H23 N3 O3)

Compound Name

2-{4-[(1E)-1-(3,4-dimethoxyphenyl)prop-1-en-2-yl]-6-phenyl-1,3,5-triazin-2-yl}phenol

IUPAC name

2-{4-[(1E)-1-(34-dimethoxyphenyl)prop-1-en-2-yl]-6-phenyl-135-triazin-2-yl}phenol

SMILES

C/C(/c1nc(-c(cccc2)c2O)nc(-c2ccccc2)n1)=C\c(cc1)cc(OC)c1OC

InChI

InChI=1S/C26H23N3O3/c1-17(15-18-13-14-22(31-2)23(16-18)32-3)24-27-25(19-9-5-4-6-10-19)29-26(28-24)20-11-7-8-12-21(20)30/h4-16,30H,1-3H3

InChI Key

HJWCNSJTKISPHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD25975245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.519

Distribution Coefficient, logD

5.517

Water Solubility, LogSw

-5.39

Polar Surface Area

61.099

Acid Dissociation Constant (pKa)

9.72

Base Dissociation Constant (pKb)

-1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

8020-3088 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8020-3088 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-3088?
Check Price and Availability of 8020-3088, 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 8020-3088 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-3088
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-3088
  • 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 8020-3088 available by request