2584-0109 Screening compound: 4-trifluoromethanesulfonylbenzene-1,2-diamine

2584-0109 Screening compound: 4-trifluoromethanesulfonylbenzene-1,2-diamine
2584-0109 Screening compound: 4-trifluoromethanesulfonylbenzene-1,2-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2584-0109
4-trifluoromethanesulfonylbenzene-1,2-diamine

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

2584-0109

Molecular Formula

C7H7F3N2O2S (C7 H7 F3 N2 O2 S)

Compound Name

4-trifluoromethanesulfonylbenzene-1,2-diamine

IUPAC name

4-trifluoromethanesulfonylbenzene-12-diamine

SMILES

Nc(ccc(S(C(F)(F)F)(=O)=O)c1)c1N

InChI

InChI=1S/C7H7F3N2O2S/c8-7(9,10)15(13,14)4-1-2-5(11)6(12)3-4/h1-3H,11-12H2

InChI Key

XHTLLPJFZIYMHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00491700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.21

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.421

Distribution Coefficient, logD

1.421

Water Solubility, LogSw

-2.25

Polar Surface Area

70.203

Acid Dissociation Constant (pKa)

18.60

Base Dissociation Constant (pKb)

2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

2584-0109 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 2584-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2584-0109?
Check Price and Availability of 2584-0109, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 2584-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2584-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2584-0109
  • 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 2584-0109 available by request