E221-0210 Screening compound: 4-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)-N-[3-(pyrrolidin-1-yl)propyl]benzamide

E221-0210 Screening compound: 4-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)-N-[3-(pyrrolidin-1-yl)propyl]benzamide
E221-0210 Screening compound: 4-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)-N-[3-(pyrrolidin-1-yl)propyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E221-0210
4-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)-N-[3-(pyrrolidin-1-yl)propyl]benzamide

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

E221-0210

Molecular Formula

C28H33N3O (C28 H33 N3 O)

Compound Name

4-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)-N-[3-(pyrrolidin-1-yl)propyl]benzamide

IUPAC name

4-(2-phenyl-4567-tetrahydro-1H-indol-1-yl)-N-[3-(pyrrolidin-1-yl)propyl]benzamide

SMILES

O=C(c(cc1)ccc1-n1c(-c2ccccc2)cc2c1CCCC2)NCCCN1CCCC1

InChI

InChI=1S/C28H33N3O/c32-28(29-17-8-20-30-18-6-7-19-30)23-13-15-25(16-14-23)31-26-12-5-4-11-24(26)21-27(31)22-9-2-1-3-10-22/h1-3,9-10,13-16,21H,4-8,11-12,17-20H2,(H,29,32)

InChI Key

OJGRSPZNEVNQDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14848909

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.59

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.913

Distribution Coefficient, logD

1.880

Water Solubility, LogSw

-4.82

Polar Surface Area

30.170

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

10.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.29

E221-0210 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with E221-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E221-0210?
Check Price and Availability of E221-0210, 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 E221-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E221-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E221-0210
  • 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 E221-0210 available by request