D306-0287 Screening compound: 2,4-dimethyl-6-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidine

D306-0287 Screening compound: 2,4-dimethyl-6-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidine
D306-0287 Screening compound: 2,4-dimethyl-6-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D306-0287
2,4-dimethyl-6-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidine

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

D306-0287

Molecular Formula

C13H13N3O2S (C13 H13 N3 O2 S)

Compound Name

2,4-dimethyl-6-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidine

IUPAC name

24-dimethyl-6-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidine

SMILES

Cc1cc(SCc(cc2)ccc2[N+]([O-])=O)nc(C)n1

InChI

InChI=1S/C13H13N3O2S/c1-9-7-13(15-10(2)14-9)19-8-11-3-5-12(6-4-11)16(17)18/h3-7H,8H2,1-2H3

InChI Key

ZGDWZWZWKMIAHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10480170

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

275.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.717

Distribution Coefficient, logD

2.715

Water Solubility, LogSw

-2.92

Polar Surface Area

50.700

Acid Dissociation Constant (pKa)

24.25

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with D306-0287 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D306-0287?
Check Price and Availability of D306-0287, 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 D306-0287 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D306-0287
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D306-0287
  • 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 D306-0287 available by request