P637-0447 Screening compound: 2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-[(3-methoxyphenyl)methyl]acetamide

P637-0447 Screening compound: 2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-[(3-methoxyphenyl)methyl]acetamide
P637-0447 Screening compound: 2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-[(3-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P637-0447
2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-[(3-methoxyphenyl)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

P637-0447

Molecular Formula

C18H22N4O4 (C18 H22 N4 O4)

Compound Name

2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-[(3-methoxyphenyl)methyl]acetamide

IUPAC name

2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)-N-[(3-methoxyphenyl)methyl]acetamide

SMILES

CCNC(Nc(cc1)cnc1OCC(NCc1cc(OC)ccc1)=O)=O

InChI

InChI=1S/C18H22N4O4/c1-3-19-18(24)22-14-7-8-17(21-11-14)26-12-16(23)20-10-13-5-4-6-15(9-13)25-2/h4-9,11H,3,10,12H2,1-2H3,(H,20,23)(H2,19,22,24)

InChI Key

FXMRHECPXLIZOC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27608725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.293

Distribution Coefficient, logD

2.293

Water Solubility, LogSw

-2.84

Polar Surface Area

82.042

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

P637-0447 in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 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

References: we are preparing a list of scientific research reports with P637-0447 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P637-0447?
Check Price and Availability of P637-0447, 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 P637-0447 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P637-0447
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P637-0447
  • 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 P637-0447 available by request