M503-1408 Screening compound: 4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxamide

M503-1408 Screening compound: 4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxamide
M503-1408 Screening compound: 4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M503-1408
4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-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

M503-1408

Molecular Formula

C22H22ClFN6O (C22 H22 ClFN6 O)

Compound Name

4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxamide

IUPAC name

4-amino-N-[(3-chloro-4-fluorophenyl)methyl]-2-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxamide

SMILES

Nc(nc(N(CC1)CCN1c1ccccc1)nc1)c1C(NCc(cc1)cc(Cl)c1F)=O

InChI

InChI=1S/C22H22ClFN6O/c23-18-12-15(6-7-19(18)24)13-26-21(31)17-14-27-22(28-20(17)25)30-10-8-29(9-11-30)16-4-2-1-3-5-16/h1-7,12,14H,8-11,13H2,(H,26,31)(H2,25,27,28)

InChI Key

AFSYQEVMNCSWAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20752029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.380

Distribution Coefficient, logD

3.379

Water Solubility, LogSw

-3.69

Polar Surface Area

70.081

Acid Dissociation Constant (pKa)

11.19

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

M503-1408 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M503-1408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M503-1408?
Check Price and Availability of M503-1408, 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 M503-1408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M503-1408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M503-1408
  • 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 M503-1408 available by request