D321-0715 Screening compound: methyl 4-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

D321-0715 Screening compound: methyl 4-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate
D321-0715 Screening compound: methyl 4-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D321-0715
methyl 4-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

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

D321-0715

Molecular Formula

C21H21N3O5 (C21 H21 N3 O5)

Compound Name

methyl 4-{4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate

IUPAC name

methyl 4-{4-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]butanamido}benzoate

SMILES

COC(c(cc1)ccc1NC(CCCc1nc(-c(cc2)ccc2OC)no1)=O)=O

InChI

InChI=1S/C21H21N3O5/c1-27-17-12-8-14(9-13-17)20-23-19(29-24-20)5-3-4-18(25)22-16-10-6-15(7-11-16)21(26)28-2/h6-13H,3-5H2,1-2H3,(H,22,25)

InChI Key

MGRQWJIOPBKIAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09764557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.894

Distribution Coefficient, logD

3.894

Water Solubility, LogSw

-4.16

Polar Surface Area

83.177

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

D321-0715 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D321-0715 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D321-0715?
Check Price and Availability of D321-0715, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D321-0715 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D321-0715
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D321-0715
  • 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 D321-0715 available by request