D233-0482 Screening compound: 5-chloro-N-(4-ethoxyphenyl)-2-phenylmethanesulfonylpyrimidine-4-carboxamide

D233-0482 Screening compound: 5-chloro-N-(4-ethoxyphenyl)-2-phenylmethanesulfonylpyrimidine-4-carboxamide
D233-0482 Screening compound: 5-chloro-N-(4-ethoxyphenyl)-2-phenylmethanesulfonylpyrimidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D233-0482
5-chloro-N-(4-ethoxyphenyl)-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

D233-0482

Molecular Formula

C20H18ClN3O4S (C20 H18 ClN3 O4 S)

Compound Name

5-chloro-N-(4-ethoxyphenyl)-2-phenylmethanesulfonylpyrimidine-4-carboxamide

IUPAC name

5-chloro-N-(4-ethoxyphenyl)-2-phenylmethanesulfonylpyrimidine-4-carboxamide

SMILES

CCOc(cc1)ccc1NC(c(nc(nc1)S(Cc2ccccc2)(=O)=O)c1Cl)=O

InChI

InChI=1S/C20H18ClN3O4S/c1-2-28-16-10-8-15(9-11-16)23-19(25)18-17(21)12-22-20(24-18)29(26,27)13-14-6-4-3-5-7-14/h3-12H,2,13H2,1H3,(H,23,25)

InChI Key

BYTBHAUWFZFBBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07427206

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.9

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.723

Distribution Coefficient, logD

3.694

Water Solubility, LogSw

-3.95

Polar Surface Area

78.631

Acid Dissociation Constant (pKa)

8.57

Base Dissociation Constant (pKb)

-2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

D233-0482 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D233-0482 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D233-0482?
Check Price and Availability of D233-0482, 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 D233-0482 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D233-0482
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D233-0482
  • 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 D233-0482 available by request