C200-2047 Screening compound: methyl 2-(1-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl)pyridine-3-carboxylate

C200-2047 Screening compound: methyl 2-(1-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl)pyridine-3-carboxylate
C200-2047 Screening compound: methyl 2-(1-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl)pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-2047
methyl 2-(1-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl)pyridine-3-carboxylate

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

C200-2047

Molecular Formula

C23H18ClN5O6 (C23 H18 ClN5 O6)

Compound Name

methyl 2-(1-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-3-yl)pyridine-3-carboxylate

IUPAC name

methyl 2-(1-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}-24-dioxo-1H2H3H4H-pyrido[23-d]pyrimidin-3-yl)pyridine-3-carboxylate

SMILES

COC(c1cccnc1N(C(c1cccnc1N1CC(Nc(cc(cc2)Cl)c2OC)=O)=O)C1=O)=O

InChI

InChI=1S/C23H18ClN5O6/c1-34-17-8-7-13(24)11-16(17)27-18(30)12-28-19-14(5-3-9-25-19)21(31)29(23(28)33)20-15(22(32)35-2)6-4-10-26-20/h3-11H,12H2,1-2H3,(H,27,30)

InChI Key

UEEHJCYSTGCWPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14726356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.88

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.328

Distribution Coefficient, logD

2.326

Water Solubility, LogSw

-3.44

Polar Surface Area

101.223

Acid Dissociation Constant (pKa)

9.69

Base Dissociation Constant (pKb)

1.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

C200-2047 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C200-2047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-2047?
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What is the minimum amount of C200-2047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-2047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-2047
  • 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 C200-2047 available by request