G786-1078 Screening compound: ethyl 2-(5-chloro-2-nitrobenzamido)-1,3-thiazole-4-carboxylate

G786-1078 Screening compound: ethyl 2-(5-chloro-2-nitrobenzamido)-1,3-thiazole-4-carboxylate
G786-1078 Screening compound: ethyl 2-(5-chloro-2-nitrobenzamido)-1,3-thiazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-1078
ethyl 2-(5-chloro-2-nitrobenzamido)-1,3-thiazole-4-carboxylate

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

G786-1078

Molecular Formula

C13H10ClN3O5S (C13 H10 ClN3 O5 S)

Compound Name

ethyl 2-(5-chloro-2-nitrobenzamido)-1,3-thiazole-4-carboxylate

IUPAC name

ethyl 2-(5-chloro-2-nitrobenzamido)-13-thiazole-4-carboxylate

SMILES

CCOC(c1csc(NC(c(cc(cc2)Cl)c2[N+]([O-])=O)=O)n1)=O

InChI

InChI=1S/C13H10ClN3O5S/c1-2-22-12(19)9-6-23-13(15-9)16-11(18)8-5-7(14)3-4-10(8)17(20)21/h3-6H,2H2,1H3,(H,15,16,18)

InChI Key

GFBNGGWFBRWUHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02712306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.76

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.197

Distribution Coefficient, logD

0.327

Water Solubility, LogSw

-3.74

Polar Surface Area

87.210

Acid Dissociation Constant (pKa)

4.53

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

G786-1078 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G786-1078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-1078?
Check Price and Availability of G786-1078, 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 G786-1078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-1078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-1078
  • 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 G786-1078 available by request