D101-0569 Screening compound: N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(N-methyl4-methylbenzenesulfonamido)acetamide

D101-0569 Screening compound: N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(N-methyl4-methylbenzenesulfonamido)acetamide
D101-0569 Screening compound: N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(N-methyl4-methylbenzenesulfonamido)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0569
N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(N-methyl4-methylbenzenesulfonamido)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

D101-0569

Molecular Formula

C20H22N4O5S (C20 H22 N4 O5 S)

Compound Name

N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(N-methyl4-methylbenzenesulfonamido)acetamide

IUPAC name

N-{[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]methyl}-2-(N-methyl4-methylbenzenesulfonamido)acetamide

SMILES

Cc(cc1)ccc1S(N(C)CC(NCc1nc(-c(cc2)ccc2OC)no1)=O)(=O)=O

InChI

InChI=1S/C20H22N4O5S/c1-14-4-10-17(11-5-14)30(26,27)24(2)13-18(25)21-12-19-22-20(23-29-19)15-6-8-16(28-3)9-7-15/h4-11H,12-13H2,1-3H3,(H,21,25)

InChI Key

RFGNEYRYDRHKHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07629188

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.48

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.314

Distribution Coefficient, logD

3.314

Water Solubility, LogSw

-3.71

Polar Surface Area

96.161

Acid Dissociation Constant (pKa)

12.40

Base Dissociation Constant (pKb)

-5.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D101-0569 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D101-0569 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0569?
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What is the minimum amount of D101-0569 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0569
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0569
  • 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 D101-0569 available by request