V002-4101 Screening compound: 8-(cyclopentylcarbonyl)-1-(4-fluorobenzyl)-3-isobutyl-1,4,8-triazaspiro[4.5]decan-2-one

V002-4101 Screening compound: 8-(cyclopentylcarbonyl)-1-(4-fluorobenzyl)-3-isobutyl-1,4,8-triazaspiro[4.5]decan-2-one
V002-4101 Screening compound: 8-(cyclopentylcarbonyl)-1-(4-fluorobenzyl)-3-isobutyl-1,4,8-triazaspiro[4.5]decan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-4101
8-(cyclopentylcarbonyl)-1-(4-fluorobenzyl)-3-isobutyl-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

V002-4101

Molecular Formula

C24H34FN3O2 (C24 H34 FN3 O2)

Compound Name

8-(cyclopentylcarbonyl)-1-(4-fluorobenzyl)-3-isobutyl-1,4,8-triazaspiro[4.5]decan-2-one

IUPAC name

8-cyclopentanecarbonyl-1-[(4-fluorophenyl)methyl]-3-(2-methylpropyl)-148-triazaspiro[4.5]decan-2-one

SMILES

CC(C)CC1NC(CC2)(CCN2C(C2CCCC2)=O)N(Cc(cc2)ccc2F)C1=O

InChI

InChI=1S/C24H34FN3O2/c1-17(2)15-21-23(30)28(16-18-7-9-20(25)10-8-18)24(26-21)11-13-27(14-12-24)22(29)19-5-3-4-6-19/h7-10,17,19,21,26H,3-6,11-16H2,1-2H3/t21-/m1/s1

InChI Key

GOGFYVSNRAQJBU-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19818670

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

415.55

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

3.911

Distribution Coefficient, logD

3.585

Water Solubility, LogSw

-3.90

Polar Surface Area

45.878

Acid Dissociation Constant (pKa)

15.48

Base Dissociation Constant (pKb)

7.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

V002-4101 in Drug Discovery

Included in Screening Libraries

Voltage-Gated Ion Channel-Targeted Library (4740 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 V002-4101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-4101?
Check Price and Availability of V002-4101, 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 V002-4101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-4101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-4101
  • 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 V002-4101 available by request