8015-6997 Screening compound: 1-(2-phenylethyl)-1H-pyrrole

8015-6997 Screening compound: 1-(2-phenylethyl)-1H-pyrrole
8015-6997 Screening compound: 1-(2-phenylethyl)-1H-pyrrole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-6997
1-(2-phenylethyl)-1H-pyrrole

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

8015-6997

Molecular Formula

C12H13N (C12 H13 N)

Compound Name

1-(2-phenylethyl)-1H-pyrrole

IUPAC name

1-(2-phenylethyl)-1H-pyrrole

SMILES

C(Cn1cccc1)c1ccccc1

InChI

InChI=1S/C12H13N/c1-2-6-12(7-3-1)8-11-13-9-4-5-10-13/h1-7,9-10H,8,11H2

InChI Key

KKCMGDGJMRZKJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00963302

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

171.24

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

3.093

Distribution Coefficient, logD

3.093

Water Solubility, LogSw

-2.96

Polar Surface Area

4.028

Acid Dissociation Constant (pKa)

25.66

Base Dissociation Constant (pKb)

-2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8015-6997 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8015-6997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-6997?
Check Price and Availability of 8015-6997, 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 8015-6997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-6997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-6997
  • 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 8015-6997 available by request