SA20-0052 Screening compound: 3-(dimethylamino)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpiperidine-1-sulfonamide

SA20-0052 Screening compound: 3-(dimethylamino)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpiperidine-1-sulfonamide
SA20-0052 Screening compound: 3-(dimethylamino)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpiperidine-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA20-0052
3-(dimethylamino)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpiperidine-1-sulfonamide

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

SA20-0052

Molecular Formula

C13H27N7O3S (C13 H27 N7 O3 S)

Compound Name

3-(dimethylamino)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpiperidine-1-sulfonamide

IUPAC name

3-(dimethylamino)-3-[1-(2-methoxyethyl)-1H-1234-tetrazol-5-yl]-NN-dimethylpiperidine-1-sulfonamide

SMILES

CN(C)C(CCC1)(CN1S(N(C)C)(=O)=O)c1nnnn1CCOC

InChI

InChI=1S/C13H27N7O3S/c1-17(2)13(12-14-15-16-20(12)9-10-23-5)7-6-8-19(11-13)24(21,22)18(3)4/h6-11H2,1-5H3/t13-/m0/s1

InChI Key

NKNPIJHBXBBDSG-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD32234897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.830

Distribution Coefficient, logD

-0.830

Water Solubility, LogSw

-0.58

Polar Surface Area

86.195

Acid Dissociation Constant (pKa)

23.19

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

92.31

SA20-0052 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA20-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA20-0052?
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What is the minimum amount of SA20-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA20-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA20-0052
  • 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 SA20-0052 available by request