P029-0285 Screening compound: N-{[3-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}acetamide

P029-0285 Screening compound: N-{[3-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}acetamide
P029-0285 Screening compound: N-{[3-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P029-0285
N-{[3-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]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

P029-0285

Molecular Formula

C11H12N4O3 (C11 H12 N4 O3)

Compound Name

N-{[3-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]methyl}acetamide

IUPAC name

N-{[3-(1-methyl-6-oxo-16-dihydropyridin-3-yl)-124-oxadiazol-5-yl]methyl}acetamide

SMILES

CC(NCc1nc(C(C=C2)=CN(C)C2=O)no1)=O

InChI

InChI=1S/C11H12N4O3/c1-7(16)12-5-9-13-11(14-18-9)8-3-4-10(17)15(2)6-8/h3-4,6H,5H2,1-2H3,(H,12,16)

InChI Key

XSBJALCCWQMQBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559127

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-1.256

Distribution Coefficient, logD

-1.256

Water Solubility, LogSw

-0.73

Polar Surface Area

72.663

Acid Dissociation Constant (pKa)

14.16

Base Dissociation Constant (pKb)

-3.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

P029-0285 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with P029-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P029-0285?
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What is the minimum amount of P029-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P029-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P029-0285
  • 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 P029-0285 available by request