E947-3005 Screening compound: 6-methyl-4-oxo-3-[(oxolan-2-yl)methyl]-N-(6-sulfamoylpyridin-3-yl)-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

E947-3005 Screening compound: 6-methyl-4-oxo-3-[(oxolan-2-yl)methyl]-N-(6-sulfamoylpyridin-3-yl)-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide
E947-3005 Screening compound: 6-methyl-4-oxo-3-[(oxolan-2-yl)methyl]-N-(6-sulfamoylpyridin-3-yl)-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E947-3005
6-methyl-4-oxo-3-[(oxolan-2-yl)methyl]-N-(6-sulfamoylpyridin-3-yl)-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

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

E947-3005

Molecular Formula

C18H19N5O6S (C18 H19 N5 O6 S)

Compound Name

6-methyl-4-oxo-3-[(oxolan-2-yl)methyl]-N-(6-sulfamoylpyridin-3-yl)-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

IUPAC name

6-methyl-4-oxo-3-[(oxolan-2-yl)methyl]-N-(6-sulfamoylpyridin-3-yl)-3H4H-furo[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(Nc(cc2)cnc2S(N)(=O)=O)=O)c(C(N(CC2OCCC2)C=N2)=O)c2o1

InChI

InChI=1S/C18H19N5O6S/c1-10-14(16(24)22-11-4-5-13(20-7-11)30(19,26)27)15-17(29-10)21-9-23(18(15)25)8-12-3-2-6-28-12/h4-5,7,9,12H,2-3,6,8H2,1H3,(H,22,24)(H2,19,26,27)/t12-/m1/s1

InChI Key

NHCGLNBLWUTKJK-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD27094045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.44

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-0.203

Distribution Coefficient, logD

-0.275

Water Solubility, LogSw

-2.13

Polar Surface Area

124.982

Acid Dissociation Constant (pKa)

8.14

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

E947-3005 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E947-3005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E947-3005?
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What is the minimum amount of E947-3005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E947-3005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E947-3005
  • 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 E947-3005 available by request