D420-5401 Screening compound: 4-{3-[3-(2-hydroxyquinolin-3-yl)-1,2,4-oxadiazol-5-yl]propanamido}benzamide

D420-5401 Screening compound: 4-{3-[3-(2-hydroxyquinolin-3-yl)-1,2,4-oxadiazol-5-yl]propanamido}benzamide
D420-5401 Screening compound: 4-{3-[3-(2-hydroxyquinolin-3-yl)-1,2,4-oxadiazol-5-yl]propanamido}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D420-5401
4-{3-[3-(2-hydroxyquinolin-3-yl)-1,2,4-oxadiazol-5-yl]propanamido}benzamide

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

D420-5401

Molecular Formula

C21H17N5O4 (C21 H17 N5 O4)

Compound Name

4-{3-[3-(2-hydroxyquinolin-3-yl)-1,2,4-oxadiazol-5-yl]propanamido}benzamide

IUPAC name

4-{3-[3-(2-hydroxyquinolin-3-yl)-124-oxadiazol-5-yl]propanamido}benzamide

SMILES

NC(c(cc1)ccc1NC(CCc1nc(-c2cc3ccccc3nc2O)no1)=O)=O

InChI

InChI=1S/C21H17N5O4/c22-19(28)12-5-7-14(8-6-12)23-17(27)9-10-18-25-20(26-30-18)15-11-13-3-1-2-4-16(13)24-21(15)29/h1-8,11H,9-10H2,(H2,22,28)(H,23,27)(H,24,29)

InChI Key

BSEOETPACODRLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27585113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.944

Distribution Coefficient, logD

1.330

Water Solubility, LogSw

-3.09

Polar Surface Area

113.809

Acid Dissociation Constant (pKa)

6.91

Base Dissociation Constant (pKb)

2.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with D420-5401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D420-5401?
Check Price and Availability of D420-5401, 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 D420-5401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D420-5401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D420-5401
  • 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 D420-5401 available by request