D233-0510 Screening compound: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylmethanesulfonylpyrimidine-4-carboxamide

D233-0510 Screening compound: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylmethanesulfonylpyrimidine-4-carboxamide
D233-0510 Screening compound: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylmethanesulfonylpyrimidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D233-0510
5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylmethanesulfonylpyrimidine-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

D233-0510

Molecular Formula

C22H22ClN3O5S (C22 H22 ClN3 O5 S)

Compound Name

5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylmethanesulfonylpyrimidine-4-carboxamide

IUPAC name

5-chloro-N-[2-(34-dimethoxyphenyl)ethyl]-2-phenylmethanesulfonylpyrimidine-4-carboxamide

SMILES

COc(ccc(CCNC(c(nc(nc1)S(Cc2ccccc2)(=O)=O)c1Cl)=O)c1)c1OC

InChI

InChI=1S/C22H22ClN3O5S/c1-30-18-9-8-15(12-19(18)31-2)10-11-24-21(27)20-17(23)13-25-22(26-20)32(28,29)14-16-6-4-3-5-7-16/h3-9,12-13H,10-11,14H2,1-2H3,(H,24,27)

InChI Key

HYQGOCVJWGVGRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07428353

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.95

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.395

Distribution Coefficient, logD

2.395

Water Solubility, LogSw

-3.20

Polar Surface Area

87.932

Acid Dissociation Constant (pKa)

10.75

Base Dissociation Constant (pKb)

-3.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

D233-0510 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with D233-0510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D233-0510?
Check Price and Availability of D233-0510, 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 D233-0510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D233-0510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D233-0510
  • 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 D233-0510 available by request