C607-0611 Screening compound: 2-[(4-CYCLOHEXYLPHENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A]BENZIMIDAZOLE

C607-0611 Screening compound: 2-[(4-CYCLOHEXYLPHENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A]BENZIMIDAZOLE
C607-0611 Screening compound: 2-[(4-CYCLOHEXYLPHENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A]BENZIMIDAZOLE alternative view

Chemical Structure Depiction of ChemDiv screening compound C607-0611
2-[(4-CYCLOHEXYLPHENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A]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

C607-0611

Molecular Formula

C22H25N3O2S (C22 H25 N3 O2 S)

Compound Name

2-[(4-CYCLOHEXYLPHENYL)SULFONYL]-1,2,3,4-TETRAHYDROPYRAZINO[1,2-A]BENZIMIDAZOLE

IUPAC name

n/a

SMILES

O=S(c1ccc(C2CCCCC2)cc1)(N1Cc2nc(cccc3)c3n2CC1)=O

InChI

InChI=1S/C22H25N3O2S/c26-28(27,19-12-10-18(11-13-19)17-6-2-1-3-7-17)24-14-15-25-21-9-5-4-8-20(21)23-22(25)16-24/h4-5,8-13,17H,1-3,6-7,14-16H2

InChI Key

UIIWMVJQSXLYNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775197

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.083

Distribution Coefficient, logD

4.874

Water Solubility, LogSw

-5.05

Polar Surface Area

42.813

Acid Dissociation Constant (pKa)

23.84

Base Dissociation Constant (pKb)

7.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

C607-0611 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

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

GPCR Targeted Library (31838 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C607-0611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C607-0611?
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What is the minimum amount of C607-0611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C607-0611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C607-0611
  • 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 C607-0611 available by request