E975-0420 Screening compound: 2-[3,4-bis(pyrrolidine-1-sulfonyl)-1H-pyrrol-1-yl]-N-(1,3-thiazol-2-yl)acetamide

E975-0420 Screening compound: 2-[3,4-bis(pyrrolidine-1-sulfonyl)-1H-pyrrol-1-yl]-N-(1,3-thiazol-2-yl)acetamide
E975-0420 Screening compound: 2-[3,4-bis(pyrrolidine-1-sulfonyl)-1H-pyrrol-1-yl]-N-(1,3-thiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E975-0420
2-[3,4-bis(pyrrolidine-1-sulfonyl)-1H-pyrrol-1-yl]-N-(1,3-thiazol-2-yl)acetamide

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

E975-0420

Molecular Formula

C17H23N5O5S3 (C17 H23 N5 O5 S3)

Compound Name

2-[3,4-bis(pyrrolidine-1-sulfonyl)-1H-pyrrol-1-yl]-N-(1,3-thiazol-2-yl)acetamide

IUPAC name

2-[34-bis(pyrrolidine-1-sulfonyl)-1H-pyrrol-1-yl]-N-(13-thiazol-2-yl)acetamide

SMILES

O=C(Cn(cc1S(N2CCCC2)(=O)=O)cc1S(N1CCCC1)(=O)=O)Nc1nccs1

InChI

InChI=1S/C17H23N5O5S3/c23-16(19-17-18-5-10-28-17)13-20-11-14(29(24,25)21-6-1-2-7-21)15(12-20)30(26,27)22-8-3-4-9-22/h5,10-12H,1-4,6-9,13H2,(H,18,19,23)

InChI Key

GNPLHPCCJJUCGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14934057

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.6

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.856

Distribution Coefficient, logD

0.855

Water Solubility, LogSw

-2.12

Polar Surface Area

101.617

Acid Dissociation Constant (pKa)

9.95

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.90

E975-0420 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • GPCR
  • Others
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Epigenetic
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E975-0420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E975-0420?
Check Price and Availability of E975-0420, 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 E975-0420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E975-0420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E975-0420
  • 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 E975-0420 available by request