E902-0110 Screening compound: 2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-methylphenyl)-N-propylacetamide

E902-0110 Screening compound: 2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-methylphenyl)-N-propylacetamide
E902-0110 Screening compound: 2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-methylphenyl)-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E902-0110
2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-methylphenyl)-N-propylacetamide

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

E902-0110

Molecular Formula

C23H24N4O2 (C23 H24 N4 O2)

Compound Name

2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}-N-(2-methylphenyl)-N-propylacetamide

IUPAC name

2-{8-methyl-4-oxo-3H4H5H-pyridazino[45-b]indol-3-yl}-N-(2-methylphenyl)-N-propylacetamide

SMILES

CCCN(C(CN(C1=O)N=Cc2c1[nH]c1c2cc(C)cc1)=O)c1c(C)cccc1

InChI

InChI=1S/C23H24N4O2/c1-4-11-26(20-8-6-5-7-16(20)3)21(28)14-27-23(29)22-18(13-24-27)17-12-15(2)9-10-19(17)25-22/h5-10,12-13,25H,4,11,14H2,1-3H3

InChI Key

PRXHVFYIZPAMBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14926862

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.606

Distribution Coefficient, logD

3.606

Water Solubility, LogSw

-3.76

Polar Surface Area

53.485

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

E902-0110 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E902-0110 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E902-0110?
Check Price and Availability of E902-0110, 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 E902-0110 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E902-0110
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E902-0110
  • 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 E902-0110 available by request