H027-2176C Screening compound: 3-[3,4-dihydropyrazino[1,2-a][1,3]benzimidazol-2(1H)-yl]propanamide

H027-2176C Screening compound: 3-[3,4-dihydropyrazino[1,2-a][1,3]benzimidazol-2(1H)-yl]propanamide
H027-2176C Screening compound: 3-[3,4-dihydropyrazino[1,2-a][1,3]benzimidazol-2(1H)-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound H027-2176C
3-[3,4-dihydropyrazino[1,2-a][1,3]benzimidazol-2(1H)-yl]propanamide

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

H027-2176C

Molecular Formula

C13H16N4O (C13 H16 N4 O)

Compound Name

3-[3,4-dihydropyrazino[1,2-a][1,3]benzimidazol-2(1H)-yl]propanamide

IUPAC name

3-{1811-triazatricyclo[7.4.0.0^{27}]trideca-2(7)358-tetraen-11-yl}propanamide

SMILES

NC(CCN1Cc2nc(cccc3)c3n2CC1)=O

InChI

InChI=1S/C13H16N4O/c14-12(18)5-6-16-7-8-17-11-4-2-1-3-10(11)15-13(17)9-16/h1-4H,5-9H2,(H2,14,18)

InChI Key

NWTJARLJLWNMDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27214800

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

244.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.427

Distribution Coefficient, logD

0.271

Water Solubility, LogSw

-1.42

Polar Surface Area

48.551

Acid Dissociation Constant (pKa)

14.74

Base Dissociation Constant (pKb)

7.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

H027-2176C in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Structure:
  • Fragments
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with H027-2176C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H027-2176C?
Check Price and Availability of H027-2176C, 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 H027-2176C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H027-2176C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H027-2176C
  • 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 H027-2176C available by request