T157-0111 Screening compound: N-{5H,6H,7H-cyclopenta[b]pyridin-3-yl}-4-methoxybenzamide

T157-0111 Screening compound: N-{5H,6H,7H-cyclopenta[b]pyridin-3-yl}-4-methoxybenzamide
T157-0111 Screening compound: N-{5H,6H,7H-cyclopenta[b]pyridin-3-yl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T157-0111
N-{5H,6H,7H-cyclopenta[b]pyridin-3-yl}-4-methoxybenzamide

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

T157-0111

Molecular Formula

C16H16N2O2 (C16 H16 N2 O2)

Compound Name

N-{5H,6H,7H-cyclopenta[b]pyridin-3-yl}-4-methoxybenzamide

IUPAC name

N-{5H6H7H-cyclopenta[b]pyridin-3-yl}-4-methoxybenzamide

SMILES

COc(cc1)ccc1C(Nc1cnc(CCC2)c2c1)=O

InChI

InChI=1S/C16H16N2O2/c1-20-14-7-5-11(6-8-14)16(19)18-13-9-12-3-2-4-15(12)17-10-13/h5-10H,2-4H2,1H3,(H,18,19)

InChI Key

KGJAITOQXDNKRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31973149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.747

Distribution Coefficient, logD

2.745

Water Solubility, LogSw

-3.28

Polar Surface Area

41.798

Acid Dissociation Constant (pKa)

11.18

Base Dissociation Constant (pKb)

5.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

T157-0111 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with T157-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T157-0111?
Check Price and Availability of T157-0111, 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 T157-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T157-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T157-0111
  • 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 T157-0111 available by request