8015-2326 Screening compound: N-{2,5-dioxo-1-[(pyridin-3-yl)methyl]-4-(trifluoromethyl)imidazolidin-4-yl}benzenesulfonamide

8015-2326 Screening compound: N-{2,5-dioxo-1-[(pyridin-3-yl)methyl]-4-(trifluoromethyl)imidazolidin-4-yl}benzenesulfonamide
8015-2326 Screening compound: N-{2,5-dioxo-1-[(pyridin-3-yl)methyl]-4-(trifluoromethyl)imidazolidin-4-yl}benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-2326
N-{2,5-dioxo-1-[(pyridin-3-yl)methyl]-4-(trifluoromethyl)imidazolidin-4-yl}benzenesulfonamide

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

8015-2326

Molecular Formula

C16H13F3N4O4S (C16 H13 F3 N4 O4 S)

Compound Name

N-{2,5-dioxo-1-[(pyridin-3-yl)methyl]-4-(trifluoromethyl)imidazolidin-4-yl}benzenesulfonamide

IUPAC name

N-{25-dioxo-1-[(pyridin-3-yl)methyl]-4-(trifluoromethyl)imidazolidin-4-yl}benzenesulfonamide

SMILES

O=C(C(C(F)(F)F)(NS(c1ccccc1)(=O)=O)N1)N(Cc2cnccc2)C1=O

InChI

InChI=1S/C16H13F3N4O4S/c17-16(18,19)15(22-28(26,27)12-6-2-1-3-7-12)13(24)23(14(25)21-15)10-11-5-4-8-20-9-11/h1-9,22H,10H2,(H,21,25)/t15-/m0/s1

InChI Key

CBEWGSAHPZRONA-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD03856181

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.36

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.351

Distribution Coefficient, logD

-1.106

Water Solubility, LogSw

-2.27

Polar Surface Area

92.874

Acid Dissociation Constant (pKa)

4.95

Base Dissociation Constant (pKb)

4.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

8015-2326 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8015-2326 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-2326?
Check Price and Availability of 8015-2326, 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 8015-2326 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-2326
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-2326
  • 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 8015-2326 available by request