P117-1312 Screening compound: N-[(furan-2-yl)methyl]-2-[6-(morpholin-4-yl)-1H-pyrrolo[2,3-b]pyridin-1-yl]acetamide

P117-1312 Screening compound: N-[(furan-2-yl)methyl]-2-[6-(morpholin-4-yl)-1H-pyrrolo[2,3-b]pyridin-1-yl]acetamide
P117-1312 Screening compound: N-[(furan-2-yl)methyl]-2-[6-(morpholin-4-yl)-1H-pyrrolo[2,3-b]pyridin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P117-1312
N-[(furan-2-yl)methyl]-2-[6-(morpholin-4-yl)-1H-pyrrolo[2,3-b]pyridin-1-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

P117-1312

Molecular Formula

C18H20N4O3 (C18 H20 N4 O3)

Compound Name

N-[(furan-2-yl)methyl]-2-[6-(morpholin-4-yl)-1H-pyrrolo[2,3-b]pyridin-1-yl]acetamide

IUPAC name

N-[(furan-2-yl)methyl]-2-[6-(morpholin-4-yl)-1H-pyrrolo[23-b]pyridin-1-yl]acetamide

SMILES

O=C(Cn1c2nc(N3CCOCC3)ccc2cc1)NCc1ccco1

InChI

InChI=1S/C18H20N4O3/c23-17(19-12-15-2-1-9-25-15)13-22-6-5-14-3-4-16(20-18(14)22)21-7-10-24-11-8-21/h1-6,9H,7-8,10-13H2,(H,19,23)

InChI Key

XSJHUTUUXFZFFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27565676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.558

Distribution Coefficient, logD

2.495

Water Solubility, LogSw

-2.88

Polar Surface Area

54.597

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

P117-1312 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

Hsp90-Targeted Library (11355 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P117-1312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P117-1312?
Check Price and Availability of P117-1312, 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 P117-1312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P117-1312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P117-1312
  • 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 P117-1312 available by request