E950-0232 Screening compound: ethyl 4-{1H-pyrrolo[3,2-h]quinoline-2-amido}benzoate

E950-0232 Screening compound: ethyl 4-{1H-pyrrolo[3,2-h]quinoline-2-amido}benzoate
E950-0232 Screening compound: ethyl 4-{1H-pyrrolo[3,2-h]quinoline-2-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E950-0232
ethyl 4-{1H-pyrrolo[3,2-h]quinoline-2-amido}benzoate

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

E950-0232

Molecular Formula

C21H17N3O3 (C21 H17 N3 O3)

Compound Name

ethyl 4-{1H-pyrrolo[3,2-h]quinoline-2-amido}benzoate

IUPAC name

ethyl 4-{1H-pyrrolo[32-h]quinoline-2-amido}benzoate

SMILES

CCOC(c(cc1)ccc1NC(c1cc(ccc2cccnc22)c2[nH]1)=O)=O

InChI

InChI=1S/C21H17N3O3/c1-2-27-21(26)14-7-9-16(10-8-14)23-20(25)17-12-15-6-5-13-4-3-11-22-18(13)19(15)24-17/h3-12,24H,2H2,1H3,(H,23,25)

InChI Key

VUKKLCFMGITDTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14930290

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.311

Distribution Coefficient, logD

4.310

Water Solubility, LogSw

-4.03

Polar Surface Area

63.736

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

4.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

E950-0232 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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 E950-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E950-0232?
Check Price and Availability of E950-0232, 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 E950-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E950-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E950-0232
  • 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 E950-0232 available by request