D679-0224 Screening compound: 4-chloro-2-methoxy-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

D679-0224 Screening compound: 4-chloro-2-methoxy-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
D679-0224 Screening compound: 4-chloro-2-methoxy-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-0224
4-chloro-2-methoxy-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}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

D679-0224

Molecular Formula

C14H16ClN3O3 (C14 H16 ClN3 O3)

Compound Name

4-chloro-2-methoxy-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

IUPAC name

4-chloro-2-methoxy-N-{[5-(propan-2-yl)-124-oxadiazol-3-yl]methyl}benzamide

SMILES

CC(C)c1nc(CNC(c(ccc(Cl)c2)c2OC)=O)no1

InChI

InChI=1S/C14H16ClN3O3/c1-8(2)14-17-12(18-21-14)7-16-13(19)10-5-4-9(15)6-11(10)20-3/h4-6,8H,7H2,1-3H3,(H,16,19)

InChI Key

XFHXNSYMYBVVLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596152

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.75

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.751

Distribution Coefficient, logD

3.751

Water Solubility, LogSw

-4.23

Polar Surface Area

65.222

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

-3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with D679-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-0224?
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What is the minimum amount of D679-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-0224
  • 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 D679-0224 available by request