C301-8107 Screening compound: 3,4-diethoxy-N-[4-methyl-2,6-bis(phenylamino)pyrimidin-5-yl]benzamide

C301-8107 Screening compound: 3,4-diethoxy-N-[4-methyl-2,6-bis(phenylamino)pyrimidin-5-yl]benzamide
C301-8107 Screening compound: 3,4-diethoxy-N-[4-methyl-2,6-bis(phenylamino)pyrimidin-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-8107
3,4-diethoxy-N-[4-methyl-2,6-bis(phenylamino)pyrimidin-5-yl]benzamide

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

C301-8107

Molecular Formula

C28H29N5O3 (C28 H29 N5 O3)

Compound Name

3,4-diethoxy-N-[4-methyl-2,6-bis(phenylamino)pyrimidin-5-yl]benzamide

IUPAC name

34-diethoxy-N-[4-methyl-26-bis(phenylamino)pyrimidin-5-yl]benzamide

SMILES

CCOc(ccc(C(Nc1c(Nc2ccccc2)nc(Nc2ccccc2)nc1C)=O)c1)c1OCC

InChI

InChI=1S/C28H29N5O3/c1-4-35-23-17-16-20(18-24(23)36-5-2)27(34)32-25-19(3)29-28(31-22-14-10-7-11-15-22)33-26(25)30-21-12-8-6-9-13-21/h6-18H,4-5H2,1-3H3,(H,32,34)(H2,29,30,31,33)

InChI Key

VUBLYARNAODYCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14745243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.776

Distribution Coefficient, logD

4.686

Water Solubility, LogSw

-4.49

Polar Surface Area

75.101

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

C301-8107 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

CNS targets activity set (6557 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Proteases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-8107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-8107?
Check Price and Availability of C301-8107, 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 C301-8107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-8107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-8107
  • 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 C301-8107 available by request