V024-6688 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one

V024-6688 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one
V024-6688 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-6688
1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-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

V024-6688

Molecular Formula

C31H42N4O2 (C31 H42 N4 O2)

Compound Name

1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one

IUPAC name

1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-8-(4-methylbenzoyl)-148-triazaspiro[4.5]decan-2-one

SMILES

CCC(C)C1NC(CC2)(CCN2C(c2ccc(C)cc2)=O)N(C2CCN(Cc3ccccc3)CC2)C1=O

InChI

InChI=1S/C31H42N4O2/c1-4-24(3)28-30(37)35(27-14-18-33(19-15-27)22-25-8-6-5-7-9-25)31(32-28)16-20-34(21-17-31)29(36)26-12-10-23(2)11-13-26/h5-13,24,27-28,32H,4,14-22H2,1-3H3

InChI Key

ZJMJEQDCGWKFEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19817564

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

502.7

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.294

Distribution Coefficient, logD

1.785

Water Solubility, LogSw

-4.11

Polar Surface Area

47.976

Acid Dissociation Constant (pKa)

17.29

Base Dissociation Constant (pKb)

9.91

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

54.80

V024-6688 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V024-6688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-6688?
Check Price and Availability of V024-6688, 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 V024-6688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-6688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-6688
  • 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 V024-6688 available by request