C607-0879 Screening compound: 2-[(5-BROMO-2-THIENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A][1,3]BENZIMIDAZOLE

C607-0879 Screening compound: 2-[(5-BROMO-2-THIENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A][1,3]BENZIMIDAZOLE
C607-0879 Screening compound: 2-[(5-BROMO-2-THIENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A][1,3]BENZIMIDAZOLE alternative view

Chemical Structure Depiction of ChemDiv screening compound C607-0879
2-[(5-BROMO-2-THIENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A][1,3]BENZIMIDAZOLE

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

C607-0879

Molecular Formula

C14H12BrN3O2S2 (C14 H12 BrN3 O2 S2)

Compound Name

2-[(5-BROMO-2-THIENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A][1,3]BENZIMIDAZOLE

IUPAC name

n/a

SMILES

O=S(c(s1)ccc1Br)(N1Cc2nc(cccc3)c3n2CC1)=O

InChI

InChI=1S/C14H12BrN3O2S2/c15-12-5-6-14(21-12)22(19,20)17-7-8-18-11-4-2-1-3-10(11)16-13(18)9-17/h1-6H,7-9H2

InChI Key

SZXVPGHYERQZGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.269

Distribution Coefficient, logD

2.936

Water Solubility, LogSw

-3.31

Polar Surface Area

43.910

Acid Dissociation Constant (pKa)

23.84

Base Dissociation Constant (pKb)

7.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C607-0879 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C607-0879 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C607-0879?
Check Price and Availability of C607-0879, 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 C607-0879 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C607-0879
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C607-0879
  • 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 C607-0879 available by request