G889-1414 Screening compound: 5-[(4-fluorobenzoyl)amino]-2-[(2-methoxyethyl)(2-thienylmethyl)amino]benzoic acid

G889-1414 Screening compound: 5-[(4-fluorobenzoyl)amino]-2-[(2-methoxyethyl)(2-thienylmethyl)amino]benzoic acid
G889-1414 Screening compound: 5-[(4-fluorobenzoyl)amino]-2-[(2-methoxyethyl)(2-thienylmethyl)amino]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G889-1414
5-[(4-fluorobenzoyl)amino]-2-[(2-methoxyethyl)(2-thienylmethyl)amino]benzoic acid

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

G889-1414

Molecular Formula

C22H21FN2O4S (C22 H21 FN2 O4 S)

Compound Name

5-[(4-fluorobenzoyl)amino]-2-[(2-methoxyethyl)(2-thienylmethyl)amino]benzoic acid

IUPAC name

5-(4-fluorobenzamido)-2-[(2-methoxyethyl)[(thiophen-2-yl)methyl]amino]benzoic acid

SMILES

COCCN(Cc1cccs1)c(ccc(NC(c(cc1)ccc1F)=O)c1)c1C(O)=O

InChI

InChI=1S/C22H21FN2O4S/c1-29-11-10-25(14-18-3-2-12-30-18)20-9-8-17(13-19(20)22(27)28)24-21(26)15-4-6-16(23)7-5-15/h2-9,12-13H,10-11,14H2,1H3,(H,24,26)(H,27,28)

InChI Key

YPSRVROOGWOMSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27166486

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

428.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.214

Distribution Coefficient, logD

2.247

Water Solubility, LogSw

-4.14

Polar Surface Area

63.791

Acid Dissociation Constant (pKa)

5.44

Base Dissociation Constant (pKb)

1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

G889-1414 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein-Protein Interaction Library (218420 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G889-1414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G889-1414?
Check Price and Availability of G889-1414, 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 G889-1414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G889-1414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G889-1414
  • 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 G889-1414 available by request