D278-0161 Screening compound: methyl 3-[(6-phenylpyrimidin-4-yl)amino]benzoate

D278-0161 Screening compound: methyl 3-[(6-phenylpyrimidin-4-yl)amino]benzoate
D278-0161 Screening compound: methyl 3-[(6-phenylpyrimidin-4-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D278-0161
methyl 3-[(6-phenylpyrimidin-4-yl)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

D278-0161

Molecular Formula

C18H15N3O2 (C18 H15 N3 O2)

Compound Name

methyl 3-[(6-phenylpyrimidin-4-yl)amino]benzoate

IUPAC name

methyl 3-[(6-phenylpyrimidin-4-yl)amino]benzoate

SMILES

COC(c1cc(Nc2ncnc(-c3ccccc3)c2)ccc1)=O

InChI

InChI=1S/C18H15N3O2/c1-23-18(22)14-8-5-9-15(10-14)21-17-11-16(19-12-20-17)13-6-3-2-4-7-13/h2-12H,1H3,(H,19,20,21)

InChI Key

GEKUDNXPZFTOES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09982332

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

305.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.601

Distribution Coefficient, logD

4.506

Water Solubility, LogSw

-4.46

Polar Surface Area

50.430

Acid Dissociation Constant (pKa)

18.70

Base Dissociation Constant (pKb)

6.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

D278-0161 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D278-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D278-0161?
Check Price and Availability of D278-0161, 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 D278-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D278-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D278-0161
  • 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 D278-0161 available by request