V029-0491 Screening compound: ethyl 1-{[4-(4-fluorobenzoyl)-1-oxa-4-azaspiro[4.5]dec-3-yl]carbonyl}-3-piperidinecarboxylate

V029-0491 Screening compound: ethyl 1-{[4-(4-fluorobenzoyl)-1-oxa-4-azaspiro[4.5]dec-3-yl]carbonyl}-3-piperidinecarboxylate
V029-0491 Screening compound: ethyl 1-{[4-(4-fluorobenzoyl)-1-oxa-4-azaspiro[4.5]dec-3-yl]carbonyl}-3-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-0491
ethyl 1-{[4-(4-fluorobenzoyl)-1-oxa-4-azaspiro[4.5]dec-3-yl]carbonyl}-3-piperidinecarboxylate

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

V029-0491

Molecular Formula

C24H31FN2O5 (C24 H31 FN2 O5)

Compound Name

ethyl 1-{[4-(4-fluorobenzoyl)-1-oxa-4-azaspiro[4.5]dec-3-yl]carbonyl}-3-piperidinecarboxylate

IUPAC name

ethyl 1-[4-(4-fluorobenzoyl)-1-oxa-4-azaspiro[4.5]decane-3-carbonyl]piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1C(C(COC12CCCCC2)N1C(c(cc1)ccc1F)=O)=O)=O

InChI

InChI=1S/C24H31FN2O5/c1-2-31-23(30)18-7-6-14-26(15-18)22(29)20-16-32-24(12-4-3-5-13-24)27(20)21(28)17-8-10-19(25)11-9-17/h8-11,18,20H,2-7,12-16H2,1H3

InChI Key

FGPVELNGQCUTRA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.932

Distribution Coefficient, logD

2.932

Water Solubility, LogSw

-2.94

Polar Surface Area

60.461

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

-0.59

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

62.50

V029-0491 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V029-0491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-0491?
Check Price and Availability of V029-0491, 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 V029-0491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-0491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-0491
  • 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 V029-0491 available by request