S212-0131 Screening compound: 1-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]piperidin-1-yl}-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one

S212-0131 Screening compound: 1-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]piperidin-1-yl}-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
S212-0131 Screening compound: 1-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]piperidin-1-yl}-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S212-0131
1-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]piperidin-1-yl}-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one

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

S212-0131

Molecular Formula

C15H21N5O3 (C15 H21 N5 O3)

Compound Name

1-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]piperidin-1-yl}-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one

IUPAC name

1-{3-[(3-methyl-124-oxadiazol-5-yl)methoxy]piperidin-1-yl}-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one

SMILES

Cc1nccn1CC(N(CCC1)CC1OCc1nc(C)no1)=O

InChI

InChI=1S/C15H21N5O3/c1-11-17-14(23-18-11)10-22-13-4-3-6-20(8-13)15(21)9-19-7-5-16-12(19)2/h5,7,13H,3-4,6,8-10H2,1-2H3/t13-/m0/s1

InChI Key

NQSTVUPLZSITJP-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27617626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.447

Distribution Coefficient, logD

-1.472

Water Solubility, LogSw

-0.55

Polar Surface Area

66.820

Acid Dissociation Constant (pKa)

19.14

Base Dissociation Constant (pKb)

8.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

S212-0131 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with S212-0131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S212-0131?
Check Price and Availability of S212-0131, 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 S212-0131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S212-0131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S212-0131
  • 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 S212-0131 available by request