D466-0351 Screening compound: N-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)methanesulfonamide

D466-0351 Screening compound: N-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)methanesulfonamide
D466-0351 Screening compound: N-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D466-0351
N-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)methanesulfonamide

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

D466-0351

Molecular Formula

C15H22N4O2S (C15 H22 N4 O2 S)

Compound Name

N-(2-butyl-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazol-8-yl)methanesulfonamide

IUPAC name

N-{11-butyl-1811-triazatricyclo[7.4.0.0^{27}]trideca-2(7)358-tetraen-5-yl}methanesulfonamide

SMILES

CCCCN1Cc2nc(cc(cc3)NS(C)(=O)=O)c3n2CC1

InChI

InChI=1S/C15H22N4O2S/c1-3-4-7-18-8-9-19-14-6-5-12(17-22(2,20)21)10-13(14)16-15(19)11-18/h5-6,10,17H,3-4,7-9,11H2,1-2H3

InChI Key

WVGBBVALXDTIFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09851995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.936

Distribution Coefficient, logD

1.648

Water Solubility, LogSw

-2.83

Polar Surface Area

57.031

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

7.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

D466-0351 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

CNS MPO Library (28609 compounds)

DGK Inhibitors Library (10558 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D466-0351 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D466-0351?
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What is the minimum amount of D466-0351 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D466-0351
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D466-0351
  • 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 D466-0351 available by request