M512-0212 Screening compound: ethyl 3-({1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-5-carbonyl}amino)benzoate

M512-0212 Screening compound: ethyl 3-({1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-5-carbonyl}amino)benzoate
M512-0212 Screening compound: ethyl 3-({1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-5-carbonyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound M512-0212
ethyl 3-({1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-5-carbonyl}amino)benzoate

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

M512-0212

Molecular Formula

C16H18N4O3 (C16 H18 N4 O3)

Compound Name

ethyl 3-({1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-5-carbonyl}amino)benzoate

IUPAC name

ethyl 3-({1H4H5H6H7H-imidazo[45-c]pyridine-5-carbonyl}amino)benzoate

SMILES

CCOC(c1cccc(NC(N(CC2)Cc3c2[nH]cn3)=O)c1)=O

InChI

InChI=1S/C16H18N4O3/c1-2-23-15(21)11-4-3-5-12(8-11)19-16(22)20-7-6-13-14(9-20)18-10-17-13/h3-5,8,10H,2,6-7,9H2,1H3,(H,17,18)(H,19,22)

InChI Key

HRTHWMKSILLWPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27545863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.903

Distribution Coefficient, logD

1.889

Water Solubility, LogSw

-2.66

Polar Surface Area

69.953

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

M512-0212 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

SH2 Library (10483 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M512-0212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M512-0212?
Check Price and Availability of M512-0212, 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 M512-0212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M512-0212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M512-0212
  • 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 M512-0212 available by request