C301-4355 Screening compound: 2-(1,3-benzodioxol-5-yl)-5-{[4-(4-methoxyphenyl)piperazino]methyl}-1,3,4-oxadiazole

C301-4355 Screening compound: 2-(1,3-benzodioxol-5-yl)-5-{[4-(4-methoxyphenyl)piperazino]methyl}-1,3,4-oxadiazole
C301-4355 Screening compound: 2-(1,3-benzodioxol-5-yl)-5-{[4-(4-methoxyphenyl)piperazino]methyl}-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-4355
2-(1,3-benzodioxol-5-yl)-5-{[4-(4-methoxyphenyl)piperazino]methyl}-1,3,4-oxadiazole

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

C301-4355

Molecular Formula

C21H22N4O4 (C21 H22 N4 O4)

Compound Name

2-(1,3-benzodioxol-5-yl)-5-{[4-(4-methoxyphenyl)piperazino]methyl}-1,3,4-oxadiazole

IUPAC name

n/a

SMILES

COc(cc1)ccc1N1CCN(Cc2nnc(-c(cc3)cc4c3OCO4)o2)CC1

InChI

InChI=1S/C21H22N4O4/c1-26-17-5-3-16(4-6-17)25-10-8-24(9-11-25)13-20-22-23-21(29-20)15-2-7-18-19(12-15)28-14-27-18/h2-7,12H,8-11,13-14H2,1H3

InChI Key

NSKJLHCWWSGIDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.829

Distribution Coefficient, logD

2.829

Water Solubility, LogSw

-3.21

Polar Surface Area

62.072

Acid Dissociation Constant (pKa)

27.97

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C301-4355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-4355?
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What is the minimum amount of C301-4355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-4355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-4355
  • 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 C301-4355 available by request