D047-0005 Screening compound: 3-amino-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

D047-0005 Screening compound: 3-amino-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
D047-0005 Screening compound: 3-amino-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D047-0005
3-amino-N-[(oxolan-2-yl)methyl]benzene-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

D047-0005

Molecular Formula

C11H16N2O3S (C11 H16 N2 O3 S)

Compound Name

3-amino-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

IUPAC name

3-amino-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

SMILES

Nc1cccc(S(NCC2OCCC2)(=O)=O)c1

InChI

InChI=1S/C11H16N2O3S/c12-9-3-1-5-11(7-9)17(14,15)13-8-10-4-2-6-16-10/h1,3,5,7,10,13H,2,4,6,8,12H2/t10-/m1/s1

InChI Key

ZDLTXJRLGWBEOP-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD09703282

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.373

Distribution Coefficient, logD

0.373

Water Solubility, LogSw

-2.14

Polar Surface Area

71.457

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

2.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

D047-0005 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D047-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D047-0005?
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What is the minimum amount of D047-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D047-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D047-0005
  • 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 D047-0005 available by request