D244-0137 Screening compound: 5-chloro-N-(4-fluorophenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide

D244-0137 Screening compound: 5-chloro-N-(4-fluorophenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
D244-0137 Screening compound: 5-chloro-N-(4-fluorophenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D244-0137
5-chloro-N-(4-fluorophenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-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

D244-0137

Molecular Formula

C19H15ClFN3OS (C19 H15 ClFN3 OS)

Compound Name

5-chloro-N-(4-fluorophenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide

IUPAC name

5-chloro-N-(4-fluorophenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide

SMILES

Cc1cccc(CSc(nc2)nc(C(Nc(cc3)ccc3F)=O)c2Cl)c1

InChI

InChI=1S/C19H15ClFN3OS/c1-12-3-2-4-13(9-12)11-26-19-22-10-16(20)17(24-19)18(25)23-15-7-5-14(21)6-8-15/h2-10H,11H2,1H3,(H,23,25)

InChI Key

UTUKDHCFIIVMDL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07454767

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.497

Distribution Coefficient, logD

5.434

Water Solubility, LogSw

-5.88

Polar Surface Area

41.643

Acid Dissociation Constant (pKa)

8.20

Base Dissociation Constant (pKb)

-2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with D244-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D244-0137?
Check Price and Availability of D244-0137, 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 D244-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D244-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D244-0137
  • 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 D244-0137 available by request