D216-0220 Screening compound: 1-(methylsulfonyl)-4-[4-(1H-1,2,3,4-tetraazol-1-yl)phenoxy]piperidine

D216-0220 Screening compound: 1-(methylsulfonyl)-4-[4-(1H-1,2,3,4-tetraazol-1-yl)phenoxy]piperidine
D216-0220 Screening compound: 1-(methylsulfonyl)-4-[4-(1H-1,2,3,4-tetraazol-1-yl)phenoxy]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D216-0220
1-(methylsulfonyl)-4-[4-(1H-1,2,3,4-tetraazol-1-yl)phenoxy]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

D216-0220

Molecular Formula

C13H17N5O3S (C13 H17 N5 O3 S)

Compound Name

1-(methylsulfonyl)-4-[4-(1H-1,2,3,4-tetraazol-1-yl)phenoxy]piperidine

IUPAC name

n/a

SMILES

CS(N(CC1)CCC1Oc(cc1)ccc1-n1nnnc1)(=O)=O

InChI

InChI=1S/C13H17N5O3S/c1-22(19,20)17-8-6-13(7-9-17)21-12-4-2-11(3-5-12)18-10-14-15-16-18/h2-5,10,13H,6-9H2,1H3

InChI Key

MHXKSFJXMZQUGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14814301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.104

Distribution Coefficient, logD

1.104

Water Solubility, LogSw

-2.25

Polar Surface Area

77.740

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

D216-0220 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with D216-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D216-0220?
Check Price and Availability of D216-0220, 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 D216-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D216-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D216-0220
  • 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 D216-0220 available by request