F541-0081 Screening compound: 6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1,3-dimethyl-1,2-dihydroquinoxalin-2-one

F541-0081 Screening compound: 6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1,3-dimethyl-1,2-dihydroquinoxalin-2-one
F541-0081 Screening compound: 6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1,3-dimethyl-1,2-dihydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F541-0081
6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1,3-dimethyl-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

F541-0081

Molecular Formula

C19H15BrN4O2 (C19 H15 BrN4 O2)

Compound Name

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

IUPAC name

6-{5-[(4-bromophenyl)methyl]-124-oxadiazol-3-yl}-13-dimethyl-12-dihydroquinoxalin-2-one

SMILES

CC1=Nc(cc(cc2)-c3noc(Cc(cc4)ccc4Br)n3)c2N(C)C1=O

InChI

InChI=1S/C19H15BrN4O2/c1-11-19(25)24(2)16-8-5-13(10-15(16)21-11)18-22-17(26-23-18)9-12-3-6-14(20)7-4-12/h3-8,10H,9H2,1-2H3

InChI Key

BJRYMNKZKSUGRB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27174415

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.26

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

4.023

Distribution Coefficient, logD

4.023

Water Solubility, LogSw

-4.28

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

15.80

References: we are preparing a list of scientific research reports with F541-0081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F541-0081?
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What is the minimum amount of F541-0081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F541-0081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F541-0081
  • 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 F541-0081 available by request