C724-0391 Screening compound: 2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(2-ethoxyphenyl)acetamide

C724-0391 Screening compound: 2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(2-ethoxyphenyl)acetamide
C724-0391 Screening compound: 2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(2-ethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C724-0391
2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(2-ethoxyphenyl)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

C724-0391

Molecular Formula

C27H28N4O5S (C27 H28 N4 O5 S)

Compound Name

2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3H,4H-pyrido[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(2-ethoxyphenyl)acetamide

IUPAC name

2-({3-[2-(34-dimethoxyphenyl)ethyl]-4-oxo-3H4H-pyrido[23-d]pyrimidin-2-yl}sulfanyl)-N-(2-ethoxyphenyl)acetamide

SMILES

CCOc(cccc1)c1NC(CSC(N1CCc(cc2)cc(OC)c2OC)=Nc2ncccc2C1=O)=O

InChI

InChI=1S/C27H28N4O5S/c1-4-36-21-10-6-5-9-20(21)29-24(32)17-37-27-30-25-19(8-7-14-28-25)26(33)31(27)15-13-18-11-12-22(34-2)23(16-18)35-3/h5-12,14,16H,4,13,15,17H2,1-3H3,(H,29,32)

InChI Key

YWCIFINVDLKXKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14788210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.574

Distribution Coefficient, logD

3.574

Water Solubility, LogSw

-3.68

Polar Surface Area

80.296

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with C724-0391 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C724-0391?
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What is the minimum amount of C724-0391 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C724-0391
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C724-0391
  • 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 C724-0391 available by request