E221-1384 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzamide

E221-1384 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzamide
E221-1384 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E221-1384
N-{3-[benzyl(methyl)amino]propyl}-4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}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

E221-1384

Molecular Formula

C33H37N3O (C33 H37 N3 O)

Compound Name

N-{3-[benzyl(methyl)amino]propyl}-4-{2-phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl}benzamide

IUPAC name

N-{3-[benzyl(methyl)amino]propyl}-4-{2-phenyl-1H4H5H6H7H8H-cyclohepta[b]pyrrol-1-yl}benzamide

SMILES

CN(CCCNC(c(cc1)ccc1-n1c(-c2ccccc2)cc2c1CCCCC2)=O)Cc1ccccc1

InChI

InChI=1S/C33H37N3O/c1-35(25-26-12-5-2-6-13-26)23-11-22-34-33(37)28-18-20-30(21-19-28)36-31-17-10-4-9-16-29(31)24-32(36)27-14-7-3-8-15-27/h2-3,5-8,12-15,18-21,24H,4,9-11,16-17,22-23,25H2,1H3,(H,34,37)

InChI Key

SVGJWQKRJJNEHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14849045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.68

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.361

Distribution Coefficient, logD

4.920

Water Solubility, LogSw

-5.36

Polar Surface Area

30.246

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.30

References: we are preparing a list of scientific research reports with E221-1384 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E221-1384?
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What is the minimum amount of E221-1384 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E221-1384
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E221-1384
  • 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 E221-1384 available by request