F541-0130 Screening compound: 1,3-dimethyl-6-{5-[(1E)-2-phenylethenyl]-1,2,4-oxadiazol-3-yl}-1,2-dihydroquinoxalin-2-one

F541-0130 Screening compound: 1,3-dimethyl-6-{5-[(1E)-2-phenylethenyl]-1,2,4-oxadiazol-3-yl}-1,2-dihydroquinoxalin-2-one
F541-0130 Screening compound: 1,3-dimethyl-6-{5-[(1E)-2-phenylethenyl]-1,2,4-oxadiazol-3-yl}-1,2-dihydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F541-0130
1,3-dimethyl-6-{5-[(1E)-2-phenylethenyl]-1,2,4-oxadiazol-3-yl}-1,2-dihydroquinoxalin-2-one

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

F541-0130

Molecular Formula

C20H16N4O2 (C20 H16 N4 O2)

Compound Name

1,3-dimethyl-6-{5-[(1E)-2-phenylethenyl]-1,2,4-oxadiazol-3-yl}-1,2-dihydroquinoxalin-2-one

IUPAC name

13-dimethyl-6-{5-[(1E)-2-phenylethenyl]-124-oxadiazol-3-yl}-12-dihydroquinoxalin-2-one

SMILES

CC1=Nc(cc(cc2)-c3noc(/C=C/c4ccccc4)n3)c2N(C)C1=O

InChI

InChI=1S/C20H16N4O2/c1-13-20(25)24(2)17-10-9-15(12-16(17)21-13)19-22-18(26-23-19)11-8-14-6-4-3-5-7-14/h3-12H,1-2H3

InChI Key

OCHNVRIUAZDBKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27174438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.923

Distribution Coefficient, logD

3.923

Water Solubility, LogSw

-4.13

Polar Surface Area

53.732

Acid Dissociation Constant (pKa)

26.18

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

F541-0130 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F541-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F541-0130?
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What is the minimum amount of F541-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F541-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F541-0130
  • 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 F541-0130 available by request