D422-4289 Screening compound: 4-[3-(6-methyl-2-oxo-1-propyl-1,2-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]butanamide

D422-4289 Screening compound: 4-[3-(6-methyl-2-oxo-1-propyl-1,2-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]butanamide
D422-4289 Screening compound: 4-[3-(6-methyl-2-oxo-1-propyl-1,2-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D422-4289
4-[3-(6-methyl-2-oxo-1-propyl-1,2-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]butanamide

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

D422-4289

Molecular Formula

C21H25N5O3 (C21 H25 N5 O3)

Compound Name

4-[3-(6-methyl-2-oxo-1-propyl-1,2-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]butanamide

IUPAC name

4-[3-(6-methyl-2-oxo-1-propyl-12-dihydropyridin-3-yl)-124-oxadiazol-5-yl]-N-[(pyridin-3-yl)methyl]butanamide

SMILES

CCCN(C(C)=CC=C1c2noc(CCCC(NCc3cnccc3)=O)n2)C1=O

InChI

InChI=1S/C21H25N5O3/c1-3-12-26-15(2)9-10-17(21(26)28)20-24-19(29-25-20)8-4-7-18(27)23-14-16-6-5-11-22-13-16/h5-6,9-11,13H,3-4,7-8,12,14H2,1-2H3,(H,23,27)

InChI Key

HZPIVNYWJJNGRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828140

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.575

Distribution Coefficient, logD

1.573

Water Solubility, LogSw

-1.32

Polar Surface Area

80.738

Acid Dissociation Constant (pKa)

13.81

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

D422-4289 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Targeted Diversity Library (40567 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Immune system
  • animal
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D422-4289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D422-4289?
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What is the minimum amount of D422-4289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D422-4289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D422-4289
  • 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 D422-4289 available by request