7422-0113 Screening compound: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[3-(benzenesulfonyl)imidazolidin-1-yl]ethan-1-one

7422-0113 Screening compound: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[3-(benzenesulfonyl)imidazolidin-1-yl]ethan-1-one
7422-0113 Screening compound: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[3-(benzenesulfonyl)imidazolidin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7422-0113
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[3-(benzenesulfonyl)imidazolidin-1-yl]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

7422-0113

Molecular Formula

C13H15N5O3S3 (C13 H15 N5 O3 S3)

Compound Name

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

IUPAC name

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

SMILES

Nc1nnc(SCC(N(CC2)CN2S(c2ccccc2)(=O)=O)=O)s1

InChI

InChI=1S/C13H15N5O3S3/c14-12-15-16-13(23-12)22-8-11(19)17-6-7-18(9-17)24(20,21)10-4-2-1-3-5-10/h1-5H,6-9H2,(H2,14,15)

InChI Key

YWFPDZSMWWNSTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05259717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.49

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

0.940

Distribution Coefficient, logD

0.940

Water Solubility, LogSw

-2.09

Polar Surface Area

92.647

Acid Dissociation Constant (pKa)

19.56

Base Dissociation Constant (pKb)

-0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

7422-0113 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 7422-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7422-0113?
Check Price and Availability of 7422-0113, 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 7422-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7422-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7422-0113
  • 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 7422-0113 available by request