D490-0361 Screening compound: 4-[(2-fluorophenyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile

D490-0361 Screening compound: 4-[(2-fluorophenyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
D490-0361 Screening compound: 4-[(2-fluorophenyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound D490-0361
4-[(2-fluorophenyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile

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

D490-0361

Molecular Formula

C19H15FN4S (C19 H15 FN4 S)

Compound Name

4-[(2-fluorophenyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile

IUPAC name

4-[(2-fluorophenyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile

SMILES

Cc(cc1)ccc1-c1nc(SC)nc(Nc(cccc2)c2F)c1C#N

InChI

InChI=1S/C19H15FN4S/c1-12-7-9-13(10-8-12)17-14(11-21)18(24-19(23-17)25-2)22-16-6-4-3-5-15(16)20/h3-10H,1-2H3,(H,22,23,24)

InChI Key

IYBGYVBKRIGQLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10090365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.253

Distribution Coefficient, logD

5.253

Water Solubility, LogSw

-5.36

Polar Surface Area

43.941

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

D490-0361 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D490-0361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D490-0361?
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What is the minimum amount of D490-0361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D490-0361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D490-0361
  • 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 D490-0361 available by request