C733-0773 Screening compound: N-(2,5-dimethylphenyl)-2-{2,4-dioxo-3-[(thiophen-2-yl)methyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-1-yl}acetamide

C733-0773 Screening compound: N-(2,5-dimethylphenyl)-2-{2,4-dioxo-3-[(thiophen-2-yl)methyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-1-yl}acetamide
C733-0773 Screening compound: N-(2,5-dimethylphenyl)-2-{2,4-dioxo-3-[(thiophen-2-yl)methyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C733-0773
N-(2,5-dimethylphenyl)-2-{2,4-dioxo-3-[(thiophen-2-yl)methyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-1-yl}acetamide

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

C733-0773

Molecular Formula

C22H20N4O3S (C22 H20 N4 O3 S)

Compound Name

N-(2,5-dimethylphenyl)-2-{2,4-dioxo-3-[(thiophen-2-yl)methyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-1-yl}acetamide

IUPAC name

N-(25-dimethylphenyl)-2-{24-dioxo-3-[(thiophen-2-yl)methyl]-1H2H3H4H-pyrido[23-d]pyrimidin-1-yl}acetamide

SMILES

Cc1cc(NC(CN(c(nccc2)c2C(N2Cc3cccs3)=O)C2=O)=O)c(C)cc1

InChI

InChI=1S/C22H20N4O3S/c1-14-7-8-15(2)18(11-14)24-19(27)13-25-20-17(6-3-9-23-20)21(28)26(22(25)29)12-16-5-4-10-30-16/h3-11H,12-13H2,1-2H3,(H,24,27)

InChI Key

WILYEHIADWYOCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14789412

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.148

Distribution Coefficient, logD

3.148

Water Solubility, LogSw

-3.22

Polar Surface Area

65.068

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

C733-0773 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C733-0773 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C733-0773?
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What is the minimum amount of C733-0773 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C733-0773
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C733-0773
  • 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 C733-0773 available by request