G793-0397 Screening compound: ethyl 3,5-dimethyl-4-(3-oxo-3-{4-[(1-phenylethyl)carbamoyl]piperidin-1-yl}propyl)-1H-pyrrole-2-carboxylate

G793-0397 Screening compound: ethyl 3,5-dimethyl-4-(3-oxo-3-{4-[(1-phenylethyl)carbamoyl]piperidin-1-yl}propyl)-1H-pyrrole-2-carboxylate
G793-0397 Screening compound: ethyl 3,5-dimethyl-4-(3-oxo-3-{4-[(1-phenylethyl)carbamoyl]piperidin-1-yl}propyl)-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G793-0397
ethyl 3,5-dimethyl-4-(3-oxo-3-{4-[(1-phenylethyl)carbamoyl]piperidin-1-yl}propyl)-1H-pyrrole-2-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

G793-0397

Molecular Formula

C26H35N3O4 (C26 H35 N3 O4)

Compound Name

ethyl 3,5-dimethyl-4-(3-oxo-3-{4-[(1-phenylethyl)carbamoyl]piperidin-1-yl}propyl)-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 35-dimethyl-4-(3-oxo-3-{4-[(1-phenylethyl)carbamoyl]piperidin-1-yl}propyl)-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CCC(N(CC2)CCC2C(NC(C)c2ccccc2)=O)=O)c(C)[nH]1)=O

InChI

InChI=1S/C26H35N3O4/c1-5-33-26(32)24-17(2)22(19(4)27-24)11-12-23(30)29-15-13-21(14-16-29)25(31)28-18(3)20-9-7-6-8-10-20/h6-10,18,21,27H,5,11-16H2,1-4H3,(H,28,31)/t18-/m0/s1

InChI Key

SQFKFDVJDBFHOE-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27159026

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.918

Distribution Coefficient, logD

2.918

Water Solubility, LogSw

-3.08

Polar Surface Area

71.671

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

-0.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

G793-0397 in Drug Discovery

Included in Screening Libraries

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

CORONAVIRUS Library (20774 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PLpro Library (6343 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G793-0397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G793-0397?
Check Price and Availability of G793-0397, 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 G793-0397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G793-0397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G793-0397
  • 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 G793-0397 available by request