E950-0159 Screening compound: 1-(4-chlorophenyl)-4-{1H-pyrrolo[3,2-h]quinoline-2-carbonyl}piperazine

E950-0159 Screening compound: 1-(4-chlorophenyl)-4-{1H-pyrrolo[3,2-h]quinoline-2-carbonyl}piperazine
E950-0159 Screening compound: 1-(4-chlorophenyl)-4-{1H-pyrrolo[3,2-h]quinoline-2-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E950-0159
1-(4-chlorophenyl)-4-{1H-pyrrolo[3,2-h]quinoline-2-carbonyl}piperazine

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

E950-0159

Molecular Formula

C22H19ClN4O (C22 H19 ClN4 O)

Compound Name

1-(4-chlorophenyl)-4-{1H-pyrrolo[3,2-h]quinoline-2-carbonyl}piperazine

IUPAC name

1-(4-chlorophenyl)-4-{1H-pyrrolo[32-h]quinoline-2-carbonyl}piperazine

SMILES

O=C(c1cc(ccc2cccnc22)c2[nH]1)N(CC1)CCN1c(cc1)ccc1Cl

InChI

InChI=1S/C22H19ClN4O/c23-17-5-7-18(8-6-17)26-10-12-27(13-11-26)22(28)19-14-16-4-3-15-2-1-9-24-20(15)21(16)25-19/h1-9,14,25H,10-13H2

InChI Key

LNBAFAYABIDCSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14930254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.296

Distribution Coefficient, logD

4.295

Water Solubility, LogSw

-4.46

Polar Surface Area

39.800

Acid Dissociation Constant (pKa)

15.76

Base Dissociation Constant (pKb)

4.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

E950-0159 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with E950-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E950-0159?
Check Price and Availability of E950-0159, 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 E950-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E950-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E950-0159
  • 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 E950-0159 available by request