E941-0100 Screening compound: N-[3-(4-ethylpiperazin-1-yl)propyl]-8-methyl-1H-pyrrolo[3,2-h]quinoline-2-carboxamide

E941-0100 Screening compound: N-[3-(4-ethylpiperazin-1-yl)propyl]-8-methyl-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
E941-0100 Screening compound: N-[3-(4-ethylpiperazin-1-yl)propyl]-8-methyl-1H-pyrrolo[3,2-h]quinoline-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E941-0100
N-[3-(4-ethylpiperazin-1-yl)propyl]-8-methyl-1H-pyrrolo[3,2-h]quinoline-2-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

E941-0100

Molecular Formula

C22H29N5O (C22 H29 N5 O)

Compound Name

N-[3-(4-ethylpiperazin-1-yl)propyl]-8-methyl-1H-pyrrolo[3,2-h]quinoline-2-carboxamide

IUPAC name

N-[3-(4-ethylpiperazin-1-yl)propyl]-8-methyl-1H-pyrrolo[32-h]quinoline-2-carboxamide

SMILES

CCN1CCN(CCCNC(c2cc(ccc3ccc(C)nc33)c3[nH]2)=O)CC1

InChI

InChI=1S/C22H29N5O/c1-3-26-11-13-27(14-12-26)10-4-9-23-22(28)19-15-18-8-7-17-6-5-16(2)24-20(17)21(18)25-19/h5-8,15,25H,3-4,9-14H2,1-2H3,(H,23,28)

InChI Key

VXACXLLTTMVEHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27093496

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.373

Distribution Coefficient, logD

1.425

Water Solubility, LogSw

-2.91

Polar Surface Area

51.040

Acid Dissociation Constant (pKa)

15.05

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

E941-0100 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E941-0100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E941-0100?
Check Price and Availability of E941-0100, 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 E941-0100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E941-0100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E941-0100
  • 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 E941-0100 available by request