E233-2098 Screening compound: 1-{2-[(2-chlorophenyl)methyl]-8-methyl-2H,4H,5H-furo[2,3-g]indazole-7-carbonyl}-4-propylpiperazine

E233-2098 Screening compound: 1-{2-[(2-chlorophenyl)methyl]-8-methyl-2H,4H,5H-furo[2,3-g]indazole-7-carbonyl}-4-propylpiperazine
E233-2098 Screening compound: 1-{2-[(2-chlorophenyl)methyl]-8-methyl-2H,4H,5H-furo[2,3-g]indazole-7-carbonyl}-4-propylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E233-2098
1-{2-[(2-chlorophenyl)methyl]-8-methyl-2H,4H,5H-furo[2,3-g]indazole-7-carbonyl}-4-propylpiperazine

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

E233-2098

Molecular Formula

C25H29ClN4O2 (C25 H29 ClN4 O2)

Compound Name

1-{2-[(2-chlorophenyl)methyl]-8-methyl-2H,4H,5H-furo[2,3-g]indazole-7-carbonyl}-4-propylpiperazine

IUPAC name

1-{2-[(2-chlorophenyl)methyl]-8-methyl-2H4H5H-furo[23-g]indazole-7-carbonyl}-4-propylpiperazine

SMILES

CCCN(CC1)CCN1C(c1c(C)c(-c2nn(Cc(cccc3)c3Cl)cc2CC2)c2o1)=O

InChI

InChI=1S/C25H29ClN4O2/c1-3-10-28-11-13-29(14-12-28)25(31)24-17(2)22-21(32-24)9-8-19-16-30(27-23(19)22)15-18-6-4-5-7-20(18)26/h4-7,16H,3,8-15H2,1-2H3

InChI Key

JTJIYKWFDDXIGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14850727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.98

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.112

Distribution Coefficient, logD

3.934

Water Solubility, LogSw

-4.52

Polar Surface Area

44.275

Acid Dissociation Constant (pKa)

21.84

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

E233-2098 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Antibacterial Compounds Library (13827 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Immune system
  • animal
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E233-2098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E233-2098?
Check Price and Availability of E233-2098, 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 E233-2098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E233-2098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E233-2098
  • 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 E233-2098 available by request