3381-0948 Screening compound: 9-ethyl-3-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-9H-carbazole

3381-0948 Screening compound: 9-ethyl-3-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-9H-carbazole
3381-0948 Screening compound: 9-ethyl-3-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-9H-carbazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3381-0948
9-ethyl-3-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-9H-carbazole

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

3381-0948

Molecular Formula

C29H35N3O3 (C29 H35 N3 O3)

Compound Name

9-ethyl-3-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-9H-carbazole

IUPAC name

9-ethyl-3-({4-[(234-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-9H-carbazole

SMILES

CCn1c(ccc(CN2CCN(Cc(c(OC)c3OC)ccc3OC)CC2)c2)c2c2c1cccc2

InChI

InChI=1S/C29H35N3O3/c1-5-32-25-9-7-6-8-23(25)24-18-21(10-12-26(24)32)19-30-14-16-31(17-15-30)20-22-11-13-27(33-2)29(35-4)28(22)34-3/h6-13,18H,5,14-17,19-20H2,1-4H3

InChI Key

GATKDRRUBJMMDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01909485

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

473.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.071

Distribution Coefficient, logD

4.078

Water Solubility, LogSw

-5.06

Polar Surface Area

31.276

Acid Dissociation Constant (pKa)

28.23

Base Dissociation Constant (pKb)

8.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

3381-0948 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Immune system
  • animal
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 3381-0948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3381-0948?
Check Price and Availability of 3381-0948, 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 3381-0948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3381-0948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3381-0948
  • 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 3381-0948 available by request