E010-0057 Screening compound: 1,3-dimethyl 5-{8-methyl-1H,4H,5H-furo[2,3-g]indazole-7-amido}benzene-1,3-dicarboxylate

E010-0057 Screening compound: 1,3-dimethyl 5-{8-methyl-1H,4H,5H-furo[2,3-g]indazole-7-amido}benzene-1,3-dicarboxylate
E010-0057 Screening compound: 1,3-dimethyl 5-{8-methyl-1H,4H,5H-furo[2,3-g]indazole-7-amido}benzene-1,3-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E010-0057
1,3-dimethyl 5-{8-methyl-1H,4H,5H-furo[2,3-g]indazole-7-amido}benzene-1,3-dicarboxylate

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

E010-0057

Molecular Formula

C21H19N3O6 (C21 H19 N3 O6)

Compound Name

1,3-dimethyl 5-{8-methyl-1H,4H,5H-furo[2,3-g]indazole-7-amido}benzene-1,3-dicarboxylate

IUPAC name

n/a

SMILES

Cc1c(C(Nc2cc(C(OC)=O)cc(C(OC)=O)c2)=O)oc(CC2)c1-c1c2cn[nH]1

InChI

InChI=1S/C21H19N3O6/c1-10-16-15(5-4-11-9-22-24-17(11)16)30-18(10)19(25)23-14-7-12(20(26)28-2)6-13(8-14)21(27)29-3/h6-9H,4-5H2,1-3H3,(H,22,24)(H,23,25)

InChI Key

VFKVREGWNAIXPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14837081

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.722

Distribution Coefficient, logD

3.722

Water Solubility, LogSw

-4.24

Polar Surface Area

98.685

Acid Dissociation Constant (pKa)

10.71

Base Dissociation Constant (pKb)

4.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

E010-0057 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with E010-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E010-0057?
Check Price and Availability of E010-0057, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E010-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E010-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E010-0057
  • 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 E010-0057 available by request