8017-2818 Screening compound: N~1~-{2-[5-(2-bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-methoxybenzamide

8017-2818 Screening compound: N~1~-{2-[5-(2-bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-methoxybenzamide
8017-2818 Screening compound: N~1~-{2-[5-(2-bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-2818
N~1~-{2-[5-(2-bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-methoxybenzamide

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

8017-2818

Molecular Formula

C23H18BrN3O4 (C23 H18 BrN3 O4)

Compound Name

N~1~-{2-[5-(2-bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}-3-methoxybenzamide

IUPAC name

N-{2-[5-(2-bromo-5-methoxyphenyl)-134-oxadiazol-2-yl]phenyl}-3-methoxybenzamide

SMILES

COc1cccc(C(Nc(cccc2)c2-c2nnc(-c(cc(cc3)OC)c3Br)o2)=O)c1

InChI

InChI=1S/C23H18BrN3O4/c1-29-15-7-5-6-14(12-15)21(28)25-20-9-4-3-8-17(20)22-26-27-23(31-22)18-13-16(30-2)10-11-19(18)24/h3-13H,1-2H3,(H,25,28)

InChI Key

SDUUZWRDRVHSJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06015587

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.688

Distribution Coefficient, logD

4.688

Water Solubility, LogSw

-4.48

Polar Surface Area

67.963

Acid Dissociation Constant (pKa)

12.09

Base Dissociation Constant (pKb)

-3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with 8017-2818 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-2818?
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What is the minimum amount of 8017-2818 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-2818
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-2818
  • 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 8017-2818 available by request