G519-0258 Screening compound: 8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide

G519-0258 Screening compound: 8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide
G519-0258 Screening compound: 8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G519-0258
8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide

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

G519-0258

Molecular Formula

C26H25N3OS2 (C26 H25 N3 OS2)

Compound Name

8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-6-phenyl-4H,5H,6H-thieno[2,3-e]indazole-2-carboxamide

IUPAC name

8-methyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-6-phenyl-4H5H6H-thieno[23-e]indazole-2-carboxamide

SMILES

Cc(c-1c2CCc3c1sc(C(NCCc(cc1)ccc1SC)=O)c3)nn2-c1ccccc1

InChI

InChI=1S/C26H25N3OS2/c1-17-24-22(29(28-17)20-6-4-3-5-7-20)13-10-19-16-23(32-25(19)24)26(30)27-15-14-18-8-11-21(31-2)12-9-18/h3-9,11-12,16H,10,13-15H2,1-2H3,(H,27,30)

InChI Key

WQMRIMICSNTRIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15015318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.64

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.223

Distribution Coefficient, logD

5.223

Water Solubility, LogSw

-5.09

Polar Surface Area

39.563

Acid Dissociation Constant (pKa)

14.73

Base Dissociation Constant (pKb)

3.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

G519-0258 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G519-0258 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G519-0258?
Check Price and Availability of G519-0258, 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 G519-0258 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G519-0258
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G519-0258
  • 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 G519-0258 available by request