1537-0002 Screening compound: 2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-6-methyl-4(3H)-pyrimidinone

1537-0002 Screening compound: 2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-6-methyl-4(3H)-pyrimidinone
1537-0002 Screening compound: 2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-6-methyl-4(3H)-pyrimidinone alternative view

Chemical Structure Depiction of ChemDiv screening compound 1537-0002
2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-6-methyl-4(3H)-pyrimidinone

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

1537-0002

Molecular Formula

C14H16N2O3S (C14 H16 N2 O3 S)

Compound Name

2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-6-methyl-4(3H)-pyrimidinone

IUPAC name

n/a

SMILES

CC(N=C(N1)SCCOc(cc2)ccc2OC)=CC1=O

InChI

InChI=1S/C14H16N2O3S/c1-10-9-13(17)16-14(15-10)20-8-7-19-12-5-3-11(18-2)4-6-12/h3-6,9H,7-8H2,1-2H3,(H,15,16,17)

InChI Key

YXKBDYWFNBGBID-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01245999

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.085

Distribution Coefficient, logD

1.351

Water Solubility, LogSw

-2.76

Polar Surface Area

49.261

Acid Dissociation Constant (pKa)

6.75

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

References: we are preparing a list of scientific research reports with 1537-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1537-0002?
Check Price and Availability of 1537-0002, 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 1537-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1537-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1537-0002
  • 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 1537-0002 available by request