3381-0933 Screening compound: 3-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)-1H-indole

3381-0933 Screening compound: 3-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)-1H-indole
3381-0933 Screening compound: 3-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3381-0933
3-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)-1H-indole

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

3381-0933

Molecular Formula

C21H25N3 (C21 H25 N3)

Compound Name

3-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)-1H-indole

IUPAC name

3-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)-1H-indole

SMILES

Cc1ccc(CN2CCN(Cc3c[nH]c4c3cccc4)CC2)cc1

InChI

InChI=1S/C21H25N3/c1-17-6-8-18(9-7-17)15-23-10-12-24(13-11-23)16-19-14-22-21-5-3-2-4-20(19)21/h2-9,14,22H,10-13,15-16H2,1H3

InChI Key

LEGQADSDIOYPOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01829044

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

319.45

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.563

Distribution Coefficient, logD

2.424

Water Solubility, LogSw

-3.43

Polar Surface Area

17.382

Acid Dissociation Constant (pKa)

18.66

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 3381-0933 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3381-0933?
Check Price and Availability of 3381-0933, 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 3381-0933 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3381-0933
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3381-0933
  • 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 3381-0933 available by request