G793-0657 Screening compound: ethyl 4-[3-(3-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

G793-0657 Screening compound: ethyl 4-[3-(3-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
G793-0657 Screening compound: ethyl 4-[3-(3-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G793-0657
ethyl 4-[3-(3-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-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

G793-0657

Molecular Formula

C27H37N3O6 (C27 H37 N3 O6)

Compound Name

ethyl 4-[3-(3-{[(2,5-dimethoxyphenyl)methyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-[3-(3-{[(25-dimethoxyphenyl)methyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CCC(N(CCC2)CC2C(NCc(cc(cc2)OC)c2OC)=O)=O)c(C)[nH]1)=O

InChI

InChI=1S/C27H37N3O6/c1-6-36-27(33)25-17(2)22(18(3)29-25)10-12-24(31)30-13-7-8-19(16-30)26(32)28-15-20-14-21(34-4)9-11-23(20)35-5/h9,11,14,19,29H,6-8,10,12-13,15-16H2,1-5H3,(H,28,32)/t19-/m0/s1

InChI Key

GBSAOEHEYRTOFV-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27159133

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.883

Distribution Coefficient, logD

2.883

Water Solubility, LogSw

-3.27

Polar Surface Area

87.615

Acid Dissociation Constant (pKa)

12.99

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

51.90

G793-0657 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with G793-0657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G793-0657?
Check Price and Availability of G793-0657, 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 G793-0657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G793-0657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G793-0657
  • 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 G793-0657 available by request