D285-0222 Screening compound: 2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N,N-diethylacetamide

D285-0222 Screening compound: 2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N,N-diethylacetamide
D285-0222 Screening compound: 2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N,N-diethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D285-0222
2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N,N-diethylacetamide

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

D285-0222

Molecular Formula

C18H20N4O2S (C18 H20 N4 O2 S)

Compound Name

2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N,N-diethylacetamide

IUPAC name

2-{[5-cyano-4-(4-methylphenyl)-6-oxo-16-dihydropyrimidin-2-yl]sulfanyl}-NN-diethylacetamide

SMILES

CCN(CC)C(CSC(NC1=O)=NC(c2ccc(C)cc2)=C1C#N)=O

InChI

InChI=1S/C18H20N4O2S/c1-4-22(5-2)15(23)11-25-18-20-16(14(10-19)17(24)21-18)13-8-6-12(3)7-9-13/h6-9H,4-5,11H2,1-3H3,(H,20,21,24)

InChI Key

MHQVEAZWQCVRFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08154738

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.392

Distribution Coefficient, logD

-1.161

Water Solubility, LogSw

-2.71

Polar Surface Area

67.115

Acid Dissociation Constant (pKa)

3.85

Base Dissociation Constant (pKb)

3.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with D285-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D285-0222?
Check Price and Availability of D285-0222, 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 D285-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D285-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D285-0222
  • 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 D285-0222 available by request