V029-0001 Screening compound: 8-methyl-N-(1-phenylethyl)-4-[2-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

V029-0001 Screening compound: 8-methyl-N-(1-phenylethyl)-4-[2-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
V029-0001 Screening compound: 8-methyl-N-(1-phenylethyl)-4-[2-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-0001
8-methyl-N-(1-phenylethyl)-4-[2-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

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

V029-0001

Molecular Formula

C26H29F3N2O3 (C26 H29 F3 N2 O3)

Compound Name

8-methyl-N-(1-phenylethyl)-4-[2-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

IUPAC name

8-methyl-N-(1-phenylethyl)-4-[2-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

SMILES

CC(c1ccccc1)NC(C(COC12CCC(C)CC2)N1C(c1c(C(F)(F)F)cccc1)=O)=O

InChI

InChI=1S/C26H29F3N2O3/c1-17-12-14-25(15-13-17)31(24(33)20-10-6-7-11-21(20)26(27,28)29)22(16-34-25)23(32)30-18(2)19-8-4-3-5-9-19/h3-11,17-18,22H,12-16H2,1-2H3,(H,30,32)

InChI Key

RKBRNAKLTKMJRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19780397

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.919

Distribution Coefficient, logD

4.919

Water Solubility, LogSw

-4.57

Polar Surface Area

46.702

Acid Dissociation Constant (pKa)

12.99

Base Dissociation Constant (pKb)

-0.90

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.20

V029-0001 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V029-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-0001?
Check Price and Availability of V029-0001, 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 V029-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-0001
  • 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 V029-0001 available by request