V029-4166 Screening compound: 1-(4-ethylpiperazin-1-yl)-3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-3-(4-methoxyphenyl)propan-1-one

V029-4166 Screening compound: 1-(4-ethylpiperazin-1-yl)-3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-3-(4-methoxyphenyl)propan-1-one
V029-4166 Screening compound: 1-(4-ethylpiperazin-1-yl)-3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-3-(4-methoxyphenyl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4166
1-(4-ethylpiperazin-1-yl)-3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-3-(4-methoxyphenyl)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

V029-4166

Molecular Formula

C31H34FN3O2 (C31 H34 FN3 O2)

Compound Name

1-(4-ethylpiperazin-1-yl)-3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-3-(4-methoxyphenyl)propan-1-one

IUPAC name

1-(4-ethylpiperazin-1-yl)-3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-3-(4-methoxyphenyl)propan-1-one

SMILES

CCN(CC1)CCN1C(CC(c1cn(Cc(cc2)ccc2F)c2c1cccc2)c(cc1)ccc1OC)=O

InChI

InChI=1S/C31H34FN3O2/c1-3-33-16-18-34(19-17-33)31(36)20-28(24-10-14-26(37-2)15-11-24)29-22-35(30-7-5-4-6-27(29)30)21-23-8-12-25(32)13-9-23/h4-15,22,28H,3,16-21H2,1-2H3/t28-/m1/s1

InChI Key

GPTRABGNIAFHJC-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD19777354

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.63

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.885

Distribution Coefficient, logD

4.565

Water Solubility, LogSw

-4.56

Polar Surface Area

28.900

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

7.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.30

V029-4166 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V029-4166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4166?
Check Price and Availability of V029-4166, 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 V029-4166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4166
  • 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 V029-4166 available by request