V008-4643 Screening compound: 3-(1-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one

V008-4643 Screening compound: 3-(1-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one
V008-4643 Screening compound: 3-(1-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-4643
3-(1-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one

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

V008-4643

Molecular Formula

C29H29F2N3O (C29 H29 F2 N3 O)

Compound Name

3-(1-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one

IUPAC name

3-(1-ethyl-1H-indol-3-yl)-3-(4-fluorophenyl)-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one

SMILES

CCn1c(cccc2)c2c(C(CC(N(CC2)CCN2c(cccc2)c2F)=O)c(cc2)ccc2F)c1

InChI

InChI=1S/C29H29F2N3O/c1-2-32-20-25(23-7-3-5-9-27(23)32)24(21-11-13-22(30)14-12-21)19-29(35)34-17-15-33(16-18-34)28-10-6-4-8-26(28)31/h3-14,20,24H,2,15-19H2,1H3/t24-/m1/s1

InChI Key

SMEFQKSWYBKSKY-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19848561

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

473.57

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.330

Distribution Coefficient, logD

5.330

Water Solubility, LogSw

-5.50

Polar Surface Area

20.776

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

4.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.60

V008-4643 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V008-4643 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-4643?
Check Price and Availability of V008-4643, 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 V008-4643 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-4643
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-4643
  • 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 V008-4643 available by request