C612-1390 Screening compound: 3-(hydroxymethyl)-N-(3-methylphenyl)pyrazine-2-carboxamide

C612-1390 Screening compound: 3-(hydroxymethyl)-N-(3-methylphenyl)pyrazine-2-carboxamide
C612-1390 Screening compound: 3-(hydroxymethyl)-N-(3-methylphenyl)pyrazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C612-1390
3-(hydroxymethyl)-N-(3-methylphenyl)pyrazine-2-carboxamide

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

C612-1390

Molecular Formula

C13H13N3O2 (C13 H13 N3 O2)

Compound Name

3-(hydroxymethyl)-N-(3-methylphenyl)pyrazine-2-carboxamide

IUPAC name

3-(hydroxymethyl)-N-(3-methylphenyl)pyrazine-2-carboxamide

SMILES

Cc1cccc(NC(c2nccnc2CO)=O)c1

InChI

InChI=1S/C13H13N3O2/c1-9-3-2-4-10(7-9)16-13(18)12-11(8-17)14-5-6-15-12/h2-7,17H,8H2,1H3,(H,16,18)

InChI Key

JVGZOZSNVOKUBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

243.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.226

Distribution Coefficient, logD

1.225

Water Solubility, LogSw

-1.98

Polar Surface Area

60.577

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

-0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

C612-1390 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with C612-1390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C612-1390?
Check Price and Availability of C612-1390, 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 C612-1390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C612-1390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C612-1390
  • 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 C612-1390 available by request