E742-0137 Screening compound: 4-[(5-chloro-2,4-dimethoxyanilino)methyl]-5-(hydroxymethyl)-2-methyl-3-pyridinol

E742-0137 Screening compound: 4-[(5-chloro-2,4-dimethoxyanilino)methyl]-5-(hydroxymethyl)-2-methyl-3-pyridinol
E742-0137 Screening compound: 4-[(5-chloro-2,4-dimethoxyanilino)methyl]-5-(hydroxymethyl)-2-methyl-3-pyridinol alternative view

Chemical Structure Depiction of ChemDiv screening compound E742-0137
4-[(5-chloro-2,4-dimethoxyanilino)methyl]-5-(hydroxymethyl)-2-methyl-3-pyridinol

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

E742-0137

Molecular Formula

C16H19ClN2O4 (C16 H19 ClN2 O4)

Compound Name

4-[(5-chloro-2,4-dimethoxyanilino)methyl]-5-(hydroxymethyl)-2-methyl-3-pyridinol

IUPAC name

n/a

SMILES

Cc1ncc(CO)c(CNc(c(OC)c2)cc(Cl)c2OC)c1O

InChI

InChI=1S/C16H19ClN2O4/c1-9-16(21)11(10(8-20)6-18-9)7-19-13-4-12(17)14(22-2)5-15(13)23-3/h4-6,19-21H,7-8H2,1-3H3

InChI Key

CAOWFYDTKGUBOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14914573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.79

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.322

Distribution Coefficient, logD

2.313

Water Solubility, LogSw

-2.82

Polar Surface Area

67.345

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

E742-0137 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E742-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E742-0137?
Check Price and Availability of E742-0137, 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 E742-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E742-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E742-0137
  • 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 E742-0137 available by request