3381-0418 Screening compound: 9-ethyl-3-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-9H-carbazole

3381-0418 Screening compound: 9-ethyl-3-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-9H-carbazole
3381-0418 Screening compound: 9-ethyl-3-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-9H-carbazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3381-0418
9-ethyl-3-{[4-(4-fluorobenzoyl)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

3381-0418

Molecular Formula

C26H26FN3O (C26 H26 FN3 O)

Compound Name

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

IUPAC name

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

SMILES

CCn1c(ccc(CN(CC2)CCN2C(c(cc2)ccc2F)=O)c2)c2c2c1cccc2

InChI

InChI=1S/C26H26FN3O/c1-2-30-24-6-4-3-5-22(24)23-17-19(7-12-25(23)30)18-28-13-15-29(16-14-28)26(31)20-8-10-21(27)11-9-20/h3-12,17H,2,13-16,18H2,1H3

InChI Key

XZKRPZKTRVPVPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01816551

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.628

Distribution Coefficient, logD

4.619

Water Solubility, LogSw

-4.36

Polar Surface Area

21.127

Acid Dissociation Constant (pKa)

28.23

Base Dissociation Constant (pKb)

5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

3381-0418 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3381-0418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3381-0418?
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What is the minimum amount of 3381-0418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3381-0418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3381-0418
  • 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 3381-0418 available by request