G839-0147 Screening compound: N-{3-carbamoyl-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-1-[(5-chlorothiophen-2-yl)sulfonyl]pyrrolidine-2-carboxamide

G839-0147 Screening compound: N-{3-carbamoyl-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-1-[(5-chlorothiophen-2-yl)sulfonyl]pyrrolidine-2-carboxamide
G839-0147 Screening compound: N-{3-carbamoyl-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-1-[(5-chlorothiophen-2-yl)sulfonyl]pyrrolidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G839-0147
N-{3-carbamoyl-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-1-[(5-chlorothiophen-2-yl)sulfonyl]pyrrolidine-2-carboxamide

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

G839-0147

Molecular Formula

C17H18ClN3O4S3 (C17 H18 ClN3 O4 S3)

Compound Name

N-{3-carbamoyl-4H,5H,6H-cyclopenta[b]thiophen-2-yl}-1-[(5-chlorothiophen-2-yl)sulfonyl]pyrrolidine-2-carboxamide

IUPAC name

N-{3-carbamoyl-4H5H6H-cyclopenta[b]thiophen-2-yl}-1-[(5-chlorothiophen-2-yl)sulfonyl]pyrrolidine-2-carboxamide

SMILES

NC(c1c(NC(C(CCC2)N2S(c(s2)ccc2Cl)(=O)=O)=O)sc2c1CCC2)=O

InChI

InChI=1S/C17H18ClN3O4S3/c18-12-6-7-13(27-12)28(24,25)21-8-2-4-10(21)16(23)20-17-14(15(19)22)9-3-1-5-11(9)26-17/h6-7,10H,1-5,8H2,(H2,19,22)(H,20,23)/t10-/m0/s1

InChI Key

CWGWWQPRXKQSLY-JTQLQIEISA-N

MDL Number (MFCD)

MFCD08022574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.679

Distribution Coefficient, logD

0.690

Water Solubility, LogSw

-3.14

Polar Surface Area

91.036

Acid Dissociation Constant (pKa)

6.46

Base Dissociation Constant (pKb)

-2.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

G839-0147 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G839-0147 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G839-0147?
Check Price and Availability of G839-0147, 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 G839-0147 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G839-0147
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G839-0147
  • 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 G839-0147 available by request