T987-2331 Screening compound: N-(2-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}cyclopentyl)-5-methylpyrazine-2-carboxamide

T987-2331 Screening compound: N-(2-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}cyclopentyl)-5-methylpyrazine-2-carboxamide
T987-2331 Screening compound: N-(2-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}cyclopentyl)-5-methylpyrazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T987-2331
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}cyclopentyl)-5-methylpyrazine-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

T987-2331

Molecular Formula

C22H28N4O4 (C22 H28 N4 O4)

Compound Name

N-(2-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}cyclopentyl)-5-methylpyrazine-2-carboxamide

IUPAC name

N-[(1R2S)-2-{[2-(34-dimethoxyphenyl)ethyl]carbamoyl}cyclopentyl]-5-methylpyrazine-2-carboxamide

SMILES

Cc(nc1)cnc1C(N[C@@H](CCC1)[C@@H]1C(NCCc(cc1)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C22H28N4O4/c1-14-12-25-18(13-24-14)22(28)26-17-6-4-5-16(17)21(27)23-10-9-15-7-8-19(29-2)20(11-15)30-3/h7-8,11-13,16-17H,4-6,9-10H2,1-3H3,(H,23,27)(H,26,28)/t16-,17+/m1/s1

InChI Key

SYVFPLDBANICCD-SJORKVTESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.813

Distribution Coefficient, logD

0.813

Water Solubility, LogSw

-2.29

Polar Surface Area

82.730

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.50

T987-2331 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Ligand-Gated Ion Channels Library (3887 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

MEF2-HDAC (class II) Modulators Library (5147 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Nervous system
  • Eye
  • Cancer
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • Epigenetic
Targets:
  • Ion Channels
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T987-2331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T987-2331?
Check Price and Availability of T987-2331, 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 T987-2331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T987-2331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T987-2331
  • 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 T987-2331 available by request