P637-0478 Screening compound: 2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-{[4-(morpholin-4-yl)phenyl]methyl}acetamide

P637-0478 Screening compound: 2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-{[4-(morpholin-4-yl)phenyl]methyl}acetamide
P637-0478 Screening compound: 2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-{[4-(morpholin-4-yl)phenyl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P637-0478
2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-{[4-(morpholin-4-yl)phenyl]methyl}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

P637-0478

Molecular Formula

C21H27N5O4 (C21 H27 N5 O4)

Compound Name

2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-{[4-(morpholin-4-yl)phenyl]methyl}acetamide

IUPAC name

2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-{[4-(morpholin-4-yl)phenyl]methyl}acetamide

SMILES

CCNC(Nc(cc1)cnc1OCC(NCc(cc1)ccc1N1CCOCC1)=O)=O

InChI

InChI=1S/C21H27N5O4/c1-2-22-21(28)25-17-5-8-20(24-14-17)30-15-19(27)23-13-16-3-6-18(7-4-16)26-9-11-29-12-10-26/h3-8,14H,2,9-13,15H2,1H3,(H,23,27)(H2,22,25,28)

InChI Key

CNXXEMQGRLHRBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27608743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.914

Distribution Coefficient, logD

1.914

Water Solubility, LogSw

-2.43

Polar Surface Area

85.859

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

P637-0478 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P637-0478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P637-0478?
Check Price and Availability of P637-0478, 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 P637-0478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P637-0478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P637-0478
  • 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 P637-0478 available by request