E946-0050 Screening compound: ethyl 4-[(2-methoxyethyl)amino]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate

E946-0050 Screening compound: ethyl 4-[(2-methoxyethyl)amino]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate
E946-0050 Screening compound: ethyl 4-[(2-methoxyethyl)amino]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E946-0050
ethyl 4-[(2-methoxyethyl)amino]-6-methylfuro[2,3-d]pyrimidine-5-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

E946-0050

Molecular Formula

C13H17N3O4 (C13 H17 N3 O4)

Compound Name

ethyl 4-[(2-methoxyethyl)amino]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate

IUPAC name

ethyl 4-[(2-methoxyethyl)amino]-6-methylfuro[23-d]pyrimidine-5-carboxylate

SMILES

CCOC(c1c(C)oc2ncnc(NCCOC)c12)=O

InChI

InChI=1S/C13H17N3O4/c1-4-19-13(17)9-8(2)20-12-10(9)11(15-7-16-12)14-5-6-18-3/h7H,4-6H2,1-3H3,(H,14,15,16)

InChI Key

FJULFVZSMTWQDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14929360

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.785

Distribution Coefficient, logD

1.785

Water Solubility, LogSw

-1.95

Polar Surface Area

68.252

Acid Dissociation Constant (pKa)

16.77

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

E946-0050 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Nucleoside Mimetics Library (2197 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E946-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E946-0050?
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What is the minimum amount of E946-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E946-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E946-0050
  • 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 E946-0050 available by request