D420-4963 Screening compound: 3-[3-(2-hydroxy-7-methylquinolin-3-yl)-1,2,4-oxadiazol-5-yl]-N-(prop-2-en-1-yl)propanamide

D420-4963 Screening compound: 3-[3-(2-hydroxy-7-methylquinolin-3-yl)-1,2,4-oxadiazol-5-yl]-N-(prop-2-en-1-yl)propanamide
D420-4963 Screening compound: 3-[3-(2-hydroxy-7-methylquinolin-3-yl)-1,2,4-oxadiazol-5-yl]-N-(prop-2-en-1-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D420-4963
3-[3-(2-hydroxy-7-methylquinolin-3-yl)-1,2,4-oxadiazol-5-yl]-N-(prop-2-en-1-yl)propanamide

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

D420-4963

Molecular Formula

C18H18N4O3 (C18 H18 N4 O3)

Compound Name

3-[3-(2-hydroxy-7-methylquinolin-3-yl)-1,2,4-oxadiazol-5-yl]-N-(prop-2-en-1-yl)propanamide

IUPAC name

3-[3-(2-hydroxy-7-methylquinolin-3-yl)-124-oxadiazol-5-yl]-N-(prop-2-en-1-yl)propanamide

SMILES

Cc1ccc(cc(-c2noc(CCC(NCC=C)=O)n2)c(O)n2)c2c1

InChI

InChI=1S/C18H18N4O3/c1-3-8-19-15(23)6-7-16-21-17(22-25-16)13-10-12-5-4-11(2)9-14(12)20-18(13)24/h3-5,9-10H,1,6-8H2,2H3,(H,19,23)(H,20,24)

InChI Key

WQVOJJUGJRMEEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27584974

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.283

Distribution Coefficient, logD

1.813

Water Solubility, LogSw

-2.92

Polar Surface Area

81.185

Acid Dissociation Constant (pKa)

7.11

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

D420-4963 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D420-4963 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D420-4963?
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What is the minimum amount of D420-4963 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D420-4963
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D420-4963
  • 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 D420-4963 available by request