E902-0105 Screening compound: N-(2-ethoxyphenyl)-N-methyl-2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}acetamide

E902-0105 Screening compound: N-(2-ethoxyphenyl)-N-methyl-2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}acetamide
E902-0105 Screening compound: N-(2-ethoxyphenyl)-N-methyl-2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E902-0105
N-(2-ethoxyphenyl)-N-methyl-2-{8-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-3-yl}acetamide

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

E902-0105

Molecular Formula

C22H22N4O3 (C22 H22 N4 O3)

Compound Name

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

IUPAC name

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

SMILES

CCOc(cccc1)c1N(C)C(CN(C1=O)N=Cc2c1[nH]c1c2cc(C)cc1)=O

InChI

InChI=1S/C22H22N4O3/c1-4-29-19-8-6-5-7-18(19)25(3)20(27)13-26-22(28)21-16(12-23-26)15-11-14(2)9-10-17(15)24-21/h5-12,24H,4,13H2,1-3H3

InChI Key

UVNNSOKXBUFKFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14926858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.692

Distribution Coefficient, logD

2.692

Water Solubility, LogSw

-3.08

Polar Surface Area

60.463

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

E902-0105 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

Dark Chemical Matter Library (18430 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with E902-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E902-0105?
Check Price and Availability of E902-0105, 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 E902-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E902-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E902-0105
  • 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 E902-0105 available by request