G519-0216 Screening compound: 1-{8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carbonyl}-4-phenyl-1,2,3,6-tetrahydropyridine

G519-0216 Screening compound: 1-{8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carbonyl}-4-phenyl-1,2,3,6-tetrahydropyridine
G519-0216 Screening compound: 1-{8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carbonyl}-4-phenyl-1,2,3,6-tetrahydropyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound G519-0216
1-{8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carbonyl}-4-phenyl-1,2,3,6-tetrahydropyridine

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

G519-0216

Molecular Formula

C28H25N3OS (C28 H25 N3 OS)

Compound Name

1-{8-methyl-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carbonyl}-4-phenyl-1,2,3,6-tetrahydropyridine

IUPAC name

1-{8-methyl-6-phenyl-4H5H6H-thieno[23-e]indazole-2-carbonyl}-4-phenyl-1236-tetrahydropyridine

SMILES

Cc(c-1c2CCc3c1sc(C(N(CC1)CC=C1c1ccccc1)=O)c3)nn2-c1ccccc1

InChI

InChI=1S/C28H25N3OS/c1-19-26-24(31(29-19)23-10-6-3-7-11-23)13-12-22-18-25(33-27(22)26)28(32)30-16-14-21(15-17-30)20-8-4-2-5-9-20/h2-11,14,18H,12-13,15-17H2,1H3

InChI Key

RCQDYKFVLAKPGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15015309

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.59

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.778

Distribution Coefficient, logD

5.778

Water Solubility, LogSw

-5.57

Polar Surface Area

31.685

Acid Dissociation Constant (pKa)

23.98

Base Dissociation Constant (pKb)

3.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

G519-0216 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G519-0216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G519-0216?
Check Price and Availability of G519-0216, 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 G519-0216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G519-0216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G519-0216
  • 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 G519-0216 available by request