D400-3963 Screening compound: 2-{2-methoxy-4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-N-[(2-methoxyphenyl)methyl]acetamide

D400-3963 Screening compound: 2-{2-methoxy-4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-N-[(2-methoxyphenyl)methyl]acetamide
D400-3963 Screening compound: 2-{2-methoxy-4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-N-[(2-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D400-3963
2-{2-methoxy-4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-N-[(2-methoxyphenyl)methyl]acetamide

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

D400-3963

Molecular Formula

C26H25N3O5 (C26 H25 N3 O5)

Compound Name

2-{2-methoxy-4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy}-N-[(2-methoxyphenyl)methyl]acetamide

IUPAC name

2-{2-methoxy-4-[5-(4-methylphenyl)-124-oxadiazol-3-yl]phenoxy}-N-[(2-methoxyphenyl)methyl]acetamide

SMILES

Cc(cc1)ccc1-c1nc(-c(cc2)cc(OC)c2OCC(NCc(cccc2)c2OC)=O)no1

InChI

InChI=1S/C26H25N3O5/c1-17-8-10-18(11-9-17)26-28-25(29-34-26)19-12-13-22(23(14-19)32-3)33-16-24(30)27-15-20-6-4-5-7-21(20)31-2/h4-14H,15-16H2,1-3H3,(H,27,30)

InChI Key

WDMVQTQISRWOCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14827527

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.994

Distribution Coefficient, logD

4.994

Water Solubility, LogSw

-4.70

Polar Surface Area

78.691

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with D400-3963 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D400-3963?
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What is the minimum amount of D400-3963 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D400-3963
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D400-3963
  • 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 D400-3963 available by request