S683-0521 Screening compound: (2R,3S)-2-(methoxymethyl)-3-phenyl-1,4-oxazinan-4-yl (1-methyl-1H-imidazol-4-yl) sulfone

S683-0521 Screening compound: (2R,3S)-2-(methoxymethyl)-3-phenyl-1,4-oxazinan-4-yl (1-methyl-1H-imidazol-4-yl) sulfone
S683-0521 Screening compound: (2R,3S)-2-(methoxymethyl)-3-phenyl-1,4-oxazinan-4-yl (1-methyl-1H-imidazol-4-yl) sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound S683-0521
(2R,3S)-2-(methoxymethyl)-3-phenyl-1,4-oxazinan-4-yl (1-methyl-1H-imidazol-4-yl) sulfone

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

S683-0521

Molecular Formula

C16H21N3O4S (C16 H21 N3 O4 S)

Compound Name

(2R,3S)-2-(methoxymethyl)-3-phenyl-1,4-oxazinan-4-yl (1-methyl-1H-imidazol-4-yl) sulfone

IUPAC name

n/a

SMILES

Cn1cnc(S(N(CCO[C@@H]2COC)[C@@H]2c2ccccc2)(=O)=O)c1

InChI

InChI=1S/C16H21N3O4S/c1-18-10-15(17-12-18)24(20,21)19-8-9-23-14(11-22-2)16(19)13-6-4-3-5-7-13/h3-7,10,12,14,16H,8-9,11H2,1-2H3/t14-,16-/m1/s1

InChI Key

LDSATUAEPFKUHB-GDBMZVCRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.103

Distribution Coefficient, logD

1.103

Water Solubility, LogSw

-2.03

Polar Surface Area

61.520

Acid Dissociation Constant (pKa)

25.59

Base Dissociation Constant (pKb)

-1.99

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

43.80

S683-0521 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 S683-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S683-0521?
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What is the minimum amount of S683-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S683-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S683-0521
  • 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 S683-0521 available by request