T738-0745 Screening compound: 1-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(propan-2-yl)piperazine

T738-0745 Screening compound: 1-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(propan-2-yl)piperazine
T738-0745 Screening compound: 1-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(propan-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T738-0745
1-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(propan-2-yl)piperazine

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

T738-0745

Molecular Formula

C18H26N4O (C18 H26 N4 O)

Compound Name

1-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(propan-2-yl)piperazine

IUPAC name

1-{2-[3-(4-methylphenyl)-124-oxadiazol-5-yl]ethyl}-4-(propan-2-yl)piperazine

SMILES

CC(C)N1CCN(CCc2nc(-c3ccc(C)cc3)no2)CC1

InChI

InChI=1S/C18H26N4O/c1-14(2)22-12-10-21(11-13-22)9-8-17-19-18(20-23-17)16-6-4-15(3)5-7-16/h4-7,14H,8-13H2,1-3H3

InChI Key

ZIZDPRGALYDVJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20736214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.457

Distribution Coefficient, logD

2.295

Water Solubility, LogSw

-3.42

Polar Surface Area

39.156

Acid Dissociation Constant (pKa)

27.95

Base Dissociation Constant (pKb)

8.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

T738-0745 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with T738-0745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T738-0745?
Check Price and Availability of T738-0745, 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 T738-0745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T738-0745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T738-0745
  • 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 T738-0745 available by request