3667-0064 Screening compound: 1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)phenyl]ethan-1-one

3667-0064 Screening compound: 1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)phenyl]ethan-1-one
3667-0064 Screening compound: 1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)phenyl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3667-0064
1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)phenyl]ethan-1-one

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

3667-0064

Molecular Formula

C14H15NO (C14 H15 NO)

Compound Name

1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)phenyl]ethan-1-one

IUPAC name

1-[4-(25-dimethyl-1H-pyrrol-1-yl)phenyl]ethan-1-one

SMILES

CC(c(cc1)ccc1-n1c(C)ccc1C)=O

InChI

InChI=1S/C14H15NO/c1-10-4-5-11(2)15(10)14-8-6-13(7-9-14)12(3)16/h4-9H,1-3H3

InChI Key

QYTWQHUEXYLNLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00051816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

213.28

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.560

Distribution Coefficient, logD

2.560

Water Solubility, LogSw

-2.59

Polar Surface Area

16.954

Acid Dissociation Constant (pKa)

21.69

Base Dissociation Constant (pKb)

-4.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with 3667-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3667-0064?
Check Price and Availability of 3667-0064, 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 3667-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3667-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3667-0064
  • 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 3667-0064 available by request