G404-1217 Screening compound: ethyl 3-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-4-amido}benzoate

G404-1217 Screening compound: ethyl 3-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-4-amido}benzoate
G404-1217 Screening compound: ethyl 3-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-4-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G404-1217
ethyl 3-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-4-amido}benzoate

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

G404-1217

Molecular Formula

C19H24N4O5S (C19 H24 N4 O5 S)

Compound Name

ethyl 3-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-4-amido}benzoate

IUPAC name

ethyl 3-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-4-amido}benzoate

SMILES

CCOC(c1cccc(NC(C(CC2)CCN2S(c2cn(C)cn2)(=O)=O)=O)c1)=O

InChI

InChI=1S/C19H24N4O5S/c1-3-28-19(25)15-5-4-6-16(11-15)21-18(24)14-7-9-23(10-8-14)29(26,27)17-12-22(2)13-20-17/h4-6,11-14H,3,7-10H2,1-2H3,(H,21,24)

InChI Key

ZWPAAVKQHWGWOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27138784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.644

Distribution Coefficient, logD

1.644

Water Solubility, LogSw

-2.54

Polar Surface Area

88.206

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

G404-1217 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Nucleoside Mimetics Library (2197 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with G404-1217 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G404-1217?
Check Price and Availability of G404-1217, 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 G404-1217 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G404-1217
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G404-1217
  • 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 G404-1217 available by request