G631-1670 Screening compound: ethyl 4-[1-(3,4-dimethylbenzenesulfonyl)-5-oxopyrrolidine-2-amido]benzoate

G631-1670 Screening compound: ethyl 4-[1-(3,4-dimethylbenzenesulfonyl)-5-oxopyrrolidine-2-amido]benzoate
G631-1670 Screening compound: ethyl 4-[1-(3,4-dimethylbenzenesulfonyl)-5-oxopyrrolidine-2-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G631-1670
ethyl 4-[1-(3,4-dimethylbenzenesulfonyl)-5-oxopyrrolidine-2-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

G631-1670

Molecular Formula

C22H24N2O6S (C22 H24 N2 O6 S)

Compound Name

ethyl 4-[1-(3,4-dimethylbenzenesulfonyl)-5-oxopyrrolidine-2-amido]benzoate

IUPAC name

ethyl 4-[1-(34-dimethylbenzenesulfonyl)-5-oxopyrrolidine-2-amido]benzoate

SMILES

CCOC(c(cc1)ccc1NC(C(CCC1=O)N1S(c1cc(C)c(C)cc1)(=O)=O)=O)=O

InChI

InChI=1S/C22H24N2O6S/c1-4-30-22(27)16-6-8-17(9-7-16)23-21(26)19-11-12-20(25)24(19)31(28,29)18-10-5-14(2)15(3)13-18/h5-10,13,19H,4,11-12H2,1-3H3,(H,23,26)/t19-/m0/s1

InChI Key

UPYJELWFNNBMOG-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27146952

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.605

Distribution Coefficient, logD

3.605

Water Solubility, LogSw

-3.84

Polar Surface Area

90.060

Acid Dissociation Constant (pKa)

10.68

Base Dissociation Constant (pKb)

-3.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

G631-1670 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G631-1670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G631-1670?
Check Price and Availability of G631-1670, 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 G631-1670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G631-1670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G631-1670
  • 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 G631-1670 available by request