D343-0570 Screening compound: ethyl 5-[6-(2,5-dimethylphenyl)-1-methyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-hydroxy-2-methylthiophene-3-carboxylate

D343-0570 Screening compound: ethyl 5-[6-(2,5-dimethylphenyl)-1-methyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-hydroxy-2-methylthiophene-3-carboxylate
D343-0570 Screening compound: ethyl 5-[6-(2,5-dimethylphenyl)-1-methyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-hydroxy-2-methylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D343-0570
ethyl 5-[6-(2,5-dimethylphenyl)-1-methyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-hydroxy-2-methylthiophene-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

D343-0570

Molecular Formula

C23H23N3O5S (C23 H23 N3 O5 S)

Compound Name

ethyl 5-[6-(2,5-dimethylphenyl)-1-methyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-hydroxy-2-methylthiophene-3-carboxylate

IUPAC name

ethyl 5-[6-(25-dimethylphenyl)-1-methyl-24-dioxo-1H2H3H4H7H-pyrrolo[23-d]pyrimidin-5-yl]-4-hydroxy-2-methylthiophene-3-carboxylate

SMILES

CCOC(c1c(C)sc(-c2c(-c3c(C)ccc(C)c3)[nH]c(N(C)C(N3)=O)c2C3=O)c1O)=O

InChI

InChI=1S/C23H23N3O5S/c1-6-31-22(29)14-12(4)32-19(18(14)27)15-16-20(26(5)23(30)25-21(16)28)24-17(15)13-9-10(2)7-8-11(13)3/h7-9,24,27H,6H2,1-5H3,(H,25,28,30)

InChI Key

QPXGUHDXCDMKMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820719

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.629

Distribution Coefficient, logD

3.864

Water Solubility, LogSw

-4.42

Polar Surface Area

88.651

Acid Dissociation Constant (pKa)

6.72

Base Dissociation Constant (pKb)

-2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

D343-0570 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiviral Library (67538 compounds)

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

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D343-0570 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D343-0570?
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What is the minimum amount of D343-0570 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D343-0570
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D343-0570
  • 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 D343-0570 available by request