SA87-0979 Screening compound: N-{[4-(2-methoxyethyl)-5-oxo-1,4-oxazinan-2-yl]methyl}-1-methyl-1H-imidazole-4-sulfonamide

SA87-0979 Screening compound: N-{[4-(2-methoxyethyl)-5-oxo-1,4-oxazinan-2-yl]methyl}-1-methyl-1H-imidazole-4-sulfonamide
SA87-0979 Screening compound: N-{[4-(2-methoxyethyl)-5-oxo-1,4-oxazinan-2-yl]methyl}-1-methyl-1H-imidazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA87-0979
N-{[4-(2-methoxyethyl)-5-oxo-1,4-oxazinan-2-yl]methyl}-1-methyl-1H-imidazole-4-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

SA87-0979

Molecular Formula

C12H20N4O5S (C12 H20 N4 O5 S)

Compound Name

N-{[4-(2-methoxyethyl)-5-oxo-1,4-oxazinan-2-yl]methyl}-1-methyl-1H-imidazole-4-sulfonamide

IUPAC name

N-{[4-(2-methoxyethyl)-5-oxomorpholin-2-yl]methyl}-1-methyl-1H-imidazole-4-sulfonamide

SMILES

Cn1cnc(S(NCC(CN2CCOC)OCC2=O)(=O)=O)c1

InChI

InChI=1S/C12H20N4O5S/c1-15-7-11(13-9-15)22(18,19)14-5-10-6-16(3-4-20-2)12(17)8-21-10/h7,9-10,14H,3-6,8H2,1-2H3/t10-/m0/s1

InChI Key

MRMBSNMVVAKUIA-JTQLQIEISA-N

MDL Number (MFCD)

MFCD32242038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-1.763

Distribution Coefficient, logD

-1.763

Water Solubility, LogSw

-1.95

Polar Surface Area

88.424

Acid Dissociation Constant (pKa)

11.04

Base Dissociation Constant (pKb)

-1.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

SA87-0979 in Drug Discovery

Included in Screening Libraries

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 SA87-0979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA87-0979?
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What is the minimum amount of SA87-0979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA87-0979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA87-0979
  • 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 SA87-0979 available by request