F953-1521 Screening compound: N-[(3-bromophenyl)methyl]-5-(3,7-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide

F953-1521 Screening compound: N-[(3-bromophenyl)methyl]-5-(3,7-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide
F953-1521 Screening compound: N-[(3-bromophenyl)methyl]-5-(3,7-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F953-1521
N-[(3-bromophenyl)methyl]-5-(3,7-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide

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

F953-1521

Molecular Formula

C20H16BrN3O3 (C20 H16 BrN3 O3)

Compound Name

N-[(3-bromophenyl)methyl]-5-(3,7-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide

IUPAC name

N-[(3-bromophenyl)methyl]-5-(37-dimethyl-1-benzofuran-2-yl)-134-oxadiazole-2-carboxamide

SMILES

Cc1c(-c2nnc(C(NCc3cccc(Br)c3)=O)o2)oc2c1cccc2C

InChI

InChI=1S/C20H16BrN3O3/c1-11-5-3-8-15-12(2)17(26-16(11)15)19-23-24-20(27-19)18(25)22-10-13-6-4-7-14(21)9-13/h3-9H,10H2,1-2H3,(H,22,25)

InChI Key

UQFGNSHRLKLHDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27206244

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.310

Distribution Coefficient, logD

4.310

Water Solubility, LogSw

-4.42

Polar Surface Area

63.926

Acid Dissociation Constant (pKa)

11.81

Base Dissociation Constant (pKb)

-4.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F953-1521 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F953-1521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F953-1521?
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What is the minimum amount of F953-1521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F953-1521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F953-1521
  • 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 F953-1521 available by request