C612-1432 Screening compound: 3-(hydroxymethyl)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide

C612-1432 Screening compound: 3-(hydroxymethyl)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide
C612-1432 Screening compound: 3-(hydroxymethyl)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C612-1432
3-(hydroxymethyl)-N-[(2-methoxyphenyl)methyl]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

C612-1432

Molecular Formula

C14H15N3O3 (C14 H15 N3 O3)

Compound Name

3-(hydroxymethyl)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide

IUPAC name

3-(hydroxymethyl)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide

SMILES

COc1c(CNC(c2nccnc2CO)=O)cccc1

InChI

InChI=1S/C14H15N3O3/c1-20-12-5-3-2-4-10(12)8-17-14(19)13-11(9-18)15-6-7-16-13/h2-7,18H,8-9H2,1H3,(H,17,19)

InChI Key

NQMXRZRXFGGUTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.678

Distribution Coefficient, logD

0.678

Water Solubility, LogSw

-1.64

Polar Surface Area

69.529

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C612-1432 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with C612-1432 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C612-1432?
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What is the minimum amount of C612-1432 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C612-1432
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C612-1432
  • 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 C612-1432 available by request