7422-0112 Screening compound: 1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one

7422-0112 Screening compound: 1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one
7422-0112 Screening compound: 1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7422-0112
1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one

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

7422-0112

Molecular Formula

C14H16N4O3S3 (C14 H16 N4 O3 S3)

Compound Name

1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one

IUPAC name

1-[3-(benzenesulfonyl)imidazolidin-1-yl]-2-[(5-methyl-134-thiadiazol-2-yl)sulfanyl]ethan-1-one

SMILES

Cc1nnc(SCC(N(CC2)CN2S(c2ccccc2)(=O)=O)=O)s1

InChI

InChI=1S/C14H16N4O3S3/c1-11-15-16-14(23-11)22-9-13(19)17-7-8-18(10-17)24(20,21)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3

InChI Key

KULPNQXMDVKHQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06197025

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.422

Distribution Coefficient, logD

1.422

Water Solubility, LogSw

-2.23

Polar Surface Area

71.656

Acid Dissociation Constant (pKa)

19.65

Base Dissociation Constant (pKb)

-0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

7422-0112 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7422-0112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7422-0112?
Check Price and Availability of 7422-0112, 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 7422-0112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7422-0112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7422-0112
  • 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 7422-0112 available by request