G947-4000 Screening compound: 2-methyl-1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]piperidine

G947-4000 Screening compound: 2-methyl-1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]piperidine
G947-4000 Screening compound: 2-methyl-1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G947-4000
2-methyl-1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]piperidine

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

G947-4000

Molecular Formula

C16H21N3O3S (C16 H21 N3 O3 S)

Compound Name

2-methyl-1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]piperidine

IUPAC name

2-methyl-1-[2-methyl-5-(5-methyl-124-oxadiazol-3-yl)benzenesulfonyl]piperidine

SMILES

CC(CCCC1)N1S(c1c(C)ccc(-c2noc(C)n2)c1)(=O)=O

InChI

InChI=1S/C16H21N3O3S/c1-11-7-8-14(16-17-13(3)22-18-16)10-15(11)23(20,21)19-9-5-4-6-12(19)2/h7-8,10,12H,4-6,9H2,1-3H3/t12-/m0/s1

InChI Key

JNQYFLAKIAMHNA-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD15076802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.481

Distribution Coefficient, logD

3.481

Water Solubility, LogSw

-3.70

Polar Surface Area

62.916

Acid Dissociation Constant (pKa)

26.27

Base Dissociation Constant (pKb)

-4.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

G947-4000 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G947-4000 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G947-4000?
Check Price and Availability of G947-4000, 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 G947-4000 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G947-4000
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G947-4000
  • 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 G947-4000 available by request