3588-0050 Screening compound: N-[(4E)-1,3-dimethyl-2-oxoimidazolidin-4-ylidene]benzenesulfonamide

3588-0050 Screening compound: N-[(4E)-1,3-dimethyl-2-oxoimidazolidin-4-ylidene]benzenesulfonamide
3588-0050 Screening compound: N-[(4E)-1,3-dimethyl-2-oxoimidazolidin-4-ylidene]benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3588-0050
N-[(4E)-1,3-dimethyl-2-oxoimidazolidin-4-ylidene]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

3588-0050

Molecular Formula

C11H13N3O3S (C11 H13 N3 O3 S)

Compound Name

N-[(4E)-1,3-dimethyl-2-oxoimidazolidin-4-ylidene]benzenesulfonamide

IUPAC name

N-[(4E)-13-dimethyl-2-oxoimidazolidin-4-ylidene]benzenesulfonamide

SMILES

CN(C/C(/N1C)=N\S(c2ccccc2)(=O)=O)C1=O

InChI

InChI=1S/C11H13N3O3S/c1-13-8-10(14(2)11(13)15)12-18(16,17)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3

InChI Key

KNLQZBULKGJPJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00445417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.423

Distribution Coefficient, logD

0.423

Water Solubility, LogSw

-2.14

Polar Surface Area

59.686

Acid Dissociation Constant (pKa)

14.93

Base Dissociation Constant (pKb)

-3.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

3588-0050 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3588-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3588-0050?
Check Price and Availability of 3588-0050, 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 3588-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3588-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3588-0050
  • 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 3588-0050 available by request