P637-0459 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)acetamide

P637-0459 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)acetamide
P637-0459 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P637-0459
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)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

P637-0459

Molecular Formula

C18H20N4O5 (C18 H20 N4 O5)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-({5-[(ethylcarbamoyl)amino]pyridin-2-yl}oxy)acetamide

SMILES

CCNC(Nc(cc1)cnc1OCC(NCc(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C18H20N4O5/c1-2-19-18(24)22-13-4-6-17(21-9-13)25-10-16(23)20-8-12-3-5-14-15(7-12)27-11-26-14/h3-7,9H,2,8,10-11H2,1H3,(H,20,23)(H2,19,22,24)

InChI Key

LKSWUROKHUEWLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27608733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.108

Distribution Coefficient, logD

2.108

Water Solubility, LogSw

-2.90

Polar Surface Area

91.613

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

P637-0459 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P637-0459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P637-0459?
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What is the minimum amount of P637-0459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P637-0459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P637-0459
  • 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 P637-0459 available by request