V007-9788 Screening compound: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]propan-1-one

V007-9788 Screening compound: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]propan-1-one
V007-9788 Screening compound: 3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-9788
3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]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

V007-9788

Molecular Formula

C31H32F3N3O2 (C31 H32 F3 N3 O2)

Compound Name

3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]propan-1-one

IUPAC name

3-(7-ethyl-1H-indol-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]propan-1-one

SMILES

CCc1cccc2c1[nH]cc2C(CC(N(CC1)CCN1c(cccc1)c1OC)=O)c1cccc(C(F)(F)F)c1

InChI

InChI=1S/C31H32F3N3O2/c1-3-21-8-7-11-24-26(20-35-30(21)24)25(22-9-6-10-23(18-22)31(32,33)34)19-29(38)37-16-14-36(15-17-37)27-12-4-5-13-28(27)39-2/h4-13,18,20,25,35H,3,14-17,19H2,1-2H3/t25-/m1/s1

InChI Key

XUEKYKOIYOJICB-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19850983

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

535.61

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.737

Distribution Coefficient, logD

6.736

Water Solubility, LogSw

-6.01

Polar Surface Area

37.319

Acid Dissociation Constant (pKa)

18.17

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.30

V007-9788 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Glucocorticoid receptors Library (4806 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V007-9788 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-9788?
Check Price and Availability of V007-9788, 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 V007-9788 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-9788
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-9788
  • 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 V007-9788 available by request