D247-0168 Screening compound: N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methoxybenzamide

D247-0168 Screening compound: N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methoxybenzamide
D247-0168 Screening compound: N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D247-0168
N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-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

D247-0168

Molecular Formula

C20H21N3O5 (C20 H21 N3 O5)

Compound Name

N-{1-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methoxybenzamide

IUPAC name

N-{1-[3-(34-dimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}-4-methoxybenzamide

SMILES

CC(c1nc(-c(cc2)cc(OC)c2OC)no1)NC(c(cc1)ccc1OC)=O

InChI

InChI=1S/C20H21N3O5/c1-12(21-19(24)13-5-8-15(25-2)9-6-13)20-22-18(23-28-20)14-7-10-16(26-3)17(11-14)27-4/h5-12H,1-4H3,(H,21,24)/t12-/m0/s1

InChI Key

LBWQPUGHRYCJQM-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD07789784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.374

Distribution Coefficient, logD

3.374

Water Solubility, LogSw

-3.69

Polar Surface Area

78.297

Acid Dissociation Constant (pKa)

12.07

Base Dissociation Constant (pKb)

-4.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

D247-0168 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with D247-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D247-0168?
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What is the minimum amount of D247-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D247-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D247-0168
  • 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 D247-0168 available by request