V007-5868 Screening compound: 2-ethyl-1-(4-{1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}piperidin-1-yl)butan-1-one

V007-5868 Screening compound: 2-ethyl-1-(4-{1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}piperidin-1-yl)butan-1-one
V007-5868 Screening compound: 2-ethyl-1-(4-{1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}piperidin-1-yl)butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-5868
2-ethyl-1-(4-{1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}piperidin-1-yl)butan-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

V007-5868

Molecular Formula

C26H31FN2O (C26 H31 FN2 O)

Compound Name

2-ethyl-1-(4-{1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}piperidin-1-yl)butan-1-one

IUPAC name

2-ethyl-1-(4-{1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}piperidin-1-yl)butan-1-one

SMILES

CCC(CC)C(N(CC1)CCC1c1cn(Cc2cccc(F)c2)c2c1cccc2)=O

InChI

InChI=1S/C26H31FN2O/c1-3-20(4-2)26(30)28-14-12-21(13-15-28)24-18-29(25-11-6-5-10-23(24)25)17-19-8-7-9-22(27)16-19/h5-11,16,18,20-21H,3-4,12-15,17H2,1-2H3

InChI Key

NJNVXMIQJGNNEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19952124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.54

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.739

Distribution Coefficient, logD

5.739

Water Solubility, LogSw

-5.67

Polar Surface Area

18.619

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

V007-5868 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V007-5868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-5868?
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What is the minimum amount of V007-5868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-5868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-5868
  • 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 V007-5868 available by request