C599-0402 Screening compound: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-phenoxy-N-(propan-2-yl)propanamide

C599-0402 Screening compound: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-phenoxy-N-(propan-2-yl)propanamide
C599-0402 Screening compound: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-phenoxy-N-(propan-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C599-0402
N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-phenoxy-N-(propan-2-yl)propanamide

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

C599-0402

Molecular Formula

C22H25N3O3 (C22 H25 N3 O3)

Compound Name

N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-phenoxy-N-(propan-2-yl)propanamide

IUPAC name

N-{[3-(3-methylphenyl)-124-oxadiazol-5-yl]methyl}-2-phenoxy-N-(propan-2-yl)propanamide

SMILES

CC(C)N(Cc1nc(-c2cc(C)ccc2)no1)C(C(C)Oc1ccccc1)=O

InChI

InChI=1S/C22H25N3O3/c1-15(2)25(22(26)17(4)27-19-11-6-5-7-12-19)14-20-23-21(24-28-20)18-10-8-9-16(3)13-18/h5-13,15,17H,14H2,1-4H3/t17-/m0/s1

InChI Key

JKZKQAJXWYXOAP-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD07037690

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.913

Distribution Coefficient, logD

4.913

Water Solubility, LogSw

-4.69

Polar Surface Area

54.325

Acid Dissociation Constant (pKa)

22.87

Base Dissociation Constant (pKb)

-3.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with C599-0402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C599-0402?
Check Price and Availability of C599-0402, 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 C599-0402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C599-0402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C599-0402
  • 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 C599-0402 available by request