0090-0032 Screening compound: 4-{4-[bis(2-hydroxyethyl)sulfamoyl]phenoxy}-N,N-bis(2-hydroxyethyl)benzene-1-sulfonamide

0090-0032 Screening compound: 4-{4-[bis(2-hydroxyethyl)sulfamoyl]phenoxy}-N,N-bis(2-hydroxyethyl)benzene-1-sulfonamide
0090-0032 Screening compound: 4-{4-[bis(2-hydroxyethyl)sulfamoyl]phenoxy}-N,N-bis(2-hydroxyethyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0090-0032
4-{4-[bis(2-hydroxyethyl)sulfamoyl]phenoxy}-N,N-bis(2-hydroxyethyl)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

0090-0032

Molecular Formula

C20H28N2O9S2 (C20 H28 N2 O9 S2)

Compound Name

4-{4-[bis(2-hydroxyethyl)sulfamoyl]phenoxy}-N,N-bis(2-hydroxyethyl)benzene-1-sulfonamide

IUPAC name

4-{4-[bis(2-hydroxyethyl)sulfamoyl]phenoxy}-NN-bis(2-hydroxyethyl)benzene-1-sulfonamide

SMILES

OCCN(CCO)S(c(cc1)ccc1Oc(cc1)ccc1S(N(CCO)CCO)(=O)=O)(=O)=O

InChI

InChI=1S/C20H28N2O9S2/c23-13-9-21(10-14-24)32(27,28)19-5-1-17(2-6-19)31-18-3-7-20(8-4-18)33(29,30)22(11-15-25)12-16-26/h1-8,23-26H,9-16H2

InChI Key

ZUEQQAXAOZPNTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00316968

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.58

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.085

Distribution Coefficient, logD

0.085

Water Solubility, LogSw

-2.14

Polar Surface Area

136.816

Acid Dissociation Constant (pKa)

15.02

Base Dissociation Constant (pKb)

-5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

0090-0032 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0090-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0090-0032?
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What is the minimum amount of 0090-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0090-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0090-0032
  • 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 0090-0032 available by request