E221-1211 Screening compound: 1-(4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzoyl)pyrrolidine

E221-1211 Screening compound: 1-(4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzoyl)pyrrolidine
E221-1211 Screening compound: 1-(4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzoyl)pyrrolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound E221-1211
1-(4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzoyl)pyrrolidine

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

E221-1211

Molecular Formula

C26H28N2O (C26 H28 N2 O)

Compound Name

1-(4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzoyl)pyrrolidine

IUPAC name

1-(4-{2-phenyl-1H4H5H6H7H8H-cyclohepta[b]pyrrol-1-yl}benzoyl)pyrrolidine

SMILES

O=C(c(cc1)ccc1-n1c(-c2ccccc2)cc2c1CCCCC2)N1CCCC1

InChI

InChI=1S/C26H28N2O/c29-26(27-17-7-8-18-27)21-13-15-23(16-14-21)28-24-12-6-2-5-11-22(24)19-25(28)20-9-3-1-4-10-20/h1,3-4,9-10,13-16,19H,2,5-8,11-12,17-18H2

InChI Key

WZXCWCWVLKUYJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14848983

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.52

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.598

Distribution Coefficient, logD

5.598

Water Solubility, LogSw

-5.86

Polar Surface Area

18.912

Acid Dissociation Constant (pKa)

26.69

Base Dissociation Constant (pKb)

-2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with E221-1211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E221-1211?
Check Price and Availability of E221-1211, 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 E221-1211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E221-1211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E221-1211
  • 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 E221-1211 available by request