V026-9223 Screening compound: 1,3-dibenzyl-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one

V026-9223 Screening compound: 1,3-dibenzyl-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one
V026-9223 Screening compound: 1,3-dibenzyl-8-(4-methylbenzoyl)-1,4,8-triazaspiro[4.5]decan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-9223
1,3-dibenzyl-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

V026-9223

Molecular Formula

C29H31N3O2 (C29 H31 N3 O2)

Compound Name

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

IUPAC name

13-dibenzyl-8-(4-methylbenzoyl)-148-triazaspiro[4.5]decan-2-one

SMILES

Cc(cc1)ccc1C(N(CC1)CCC1(NC1Cc2ccccc2)N(Cc2ccccc2)C1=O)=O

InChI

InChI=1S/C29H31N3O2/c1-22-12-14-25(15-13-22)27(33)31-18-16-29(17-19-31)30-26(20-23-8-4-2-5-9-23)28(34)32(29)21-24-10-6-3-7-11-24/h2-15,26,30H,16-21H2,1H3/t26-/m0/s1

InChI Key

HNBQDTRKISKUDB-SANMLTNESA-N

MDL Number (MFCD)

MFCD19817231

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

453.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.252

Distribution Coefficient, logD

4.205

Water Solubility, LogSw

-4.18

Polar Surface Area

45.048

Acid Dissociation Constant (pKa)

14.84

Base Dissociation Constant (pKb)

6.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.03

V026-9223 in Drug Discovery

Included in Screening Libraries

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

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with V026-9223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-9223?
Check Price and Availability of V026-9223, 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 V026-9223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-9223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-9223
  • 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 V026-9223 available by request