D299-0627 Screening compound: N-(2-chlorophenyl)-5-{[(4-ethylphenyl)methyl][(furan-2-yl)methyl]amino}-2-methanesulfonylpyrimidine-4-carboxamide

D299-0627 Screening compound: N-(2-chlorophenyl)-5-{[(4-ethylphenyl)methyl][(furan-2-yl)methyl]amino}-2-methanesulfonylpyrimidine-4-carboxamide
D299-0627 Screening compound: N-(2-chlorophenyl)-5-{[(4-ethylphenyl)methyl][(furan-2-yl)methyl]amino}-2-methanesulfonylpyrimidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D299-0627
N-(2-chlorophenyl)-5-{[(4-ethylphenyl)methyl][(furan-2-yl)methyl]amino}-2-methanesulfonylpyrimidine-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

D299-0627

Molecular Formula

C26H25ClN4O4S (C26 H25 ClN4 O4 S)

Compound Name

N-(2-chlorophenyl)-5-{[(4-ethylphenyl)methyl][(furan-2-yl)methyl]amino}-2-methanesulfonylpyrimidine-4-carboxamide

IUPAC name

N-(2-chlorophenyl)-5-{[(4-ethylphenyl)methyl][(furan-2-yl)methyl]amino}-2-methanesulfonylpyrimidine-4-carboxamide

SMILES

CCc1ccc(CN(Cc2ccco2)c(c(C(Nc(cccc2)c2Cl)=O)n2)cnc2S(C)(=O)=O)cc1

InChI

InChI=1S/C26H25ClN4O4S/c1-3-18-10-12-19(13-11-18)16-31(17-20-7-6-14-35-20)23-15-28-26(36(2,33)34)30-24(23)25(32)29-22-9-5-4-8-21(22)27/h4-15H,3,16-17H2,1-2H3,(H,29,32)

InChI Key

XMFONICYRHRIGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08547031

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.03

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.609

Distribution Coefficient, logD

4.541

Water Solubility, LogSw

-4.49

Polar Surface Area

81.985

Acid Dissociation Constant (pKa)

8.17

Base Dissociation Constant (pKb)

-2.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

D299-0627 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D299-0627 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D299-0627?
Check Price and Availability of D299-0627, 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 D299-0627 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D299-0627
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D299-0627
  • 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 D299-0627 available by request