D400-1370 Screening compound: 2,2-dimethyl-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide

D400-1370 Screening compound: 2,2-dimethyl-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide
D400-1370 Screening compound: 2,2-dimethyl-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D400-1370
2,2-dimethyl-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide

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

D400-1370

Molecular Formula

C20H21N3O2 (C20 H21 N3 O2)

Compound Name

2,2-dimethyl-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide

IUPAC name

22-dimethyl-N-{2-[3-(3-methylphenyl)-124-oxadiazol-5-yl]phenyl}propanamide

SMILES

CC(C)(C)C(Nc(cccc1)c1-c1nc(-c2cc(C)ccc2)no1)=O

InChI

InChI=1S/C20H21N3O2/c1-13-8-7-9-14(12-13)17-22-18(25-23-17)15-10-5-6-11-16(15)21-19(24)20(2,3)4/h5-12H,1-4H3,(H,21,24)

InChI Key

ODXSRKHJAYZPPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14827038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.923

Distribution Coefficient, logD

4.923

Water Solubility, LogSw

-4.59

Polar Surface Area

54.309

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D400-1370 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D400-1370 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D400-1370?
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What is the minimum amount of D400-1370 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D400-1370
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D400-1370
  • 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 D400-1370 available by request