8006-0481 Screening compound: 1-(4-nitrophenyl)-1H-pyrrole-2-carbaldehyde

8006-0481 Screening compound: 1-(4-nitrophenyl)-1H-pyrrole-2-carbaldehyde
8006-0481 Screening compound: 1-(4-nitrophenyl)-1H-pyrrole-2-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-0481
1-(4-nitrophenyl)-1H-pyrrole-2-carbaldehyde

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

8006-0481

Molecular Formula

C11H8N2O3 (C11 H8 N2 O3)

Compound Name

1-(4-nitrophenyl)-1H-pyrrole-2-carbaldehyde

IUPAC name

1-(4-nitrophenyl)-1H-pyrrole-2-carbaldehyde

SMILES

[O-][N+](c(cc1)ccc1-n1c(C=O)ccc1)=O

InChI

InChI=1S/C11H8N2O3/c14-8-11-2-1-7-12(11)9-3-5-10(6-4-9)13(15)16/h1-8H

InChI Key

HAWFRXCIWBFGHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00452154

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

216.2

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.410

Distribution Coefficient, logD

2.410

Water Solubility, LogSw

-2.35

Polar Surface Area

50.309

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8006-0481 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8006-0481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-0481?
Check Price and Availability of 8006-0481, 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 8006-0481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-0481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-0481
  • 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 8006-0481 available by request