V028-0668 Screening compound: 8-(3,4-dichlorobenzoyl)-4-(4-fluorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide

V028-0668 Screening compound: 8-(3,4-dichlorobenzoyl)-4-(4-fluorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
V028-0668 Screening compound: 8-(3,4-dichlorobenzoyl)-4-(4-fluorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0668
8-(3,4-dichlorobenzoyl)-4-(4-fluorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[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

V028-0668

Molecular Formula

C27H28Cl2FN3O5 (C27 H28 Cl2 FN3 O5)

Compound Name

8-(3,4-dichlorobenzoyl)-4-(4-fluorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide

IUPAC name

8-(34-dichlorobenzoyl)-4-(4-fluorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-48-diazaspiro[4.5]decane-3-carboxamide

SMILES

O=C(C(COC1(CC2)CCN2C(c(cc2)cc(Cl)c2Cl)=O)N1C(c(cc1)ccc1F)=O)NCC1OCCC1

InChI

InChI=1S/C27H28Cl2FN3O5/c28-21-8-5-18(14-22(21)29)25(35)32-11-9-27(10-12-32)33(26(36)17-3-6-19(30)7-4-17)23(16-38-27)24(34)31-15-20-2-1-13-37-20/h3-8,14,20,23H,1-2,9-13,15-16H2,(H,31,34)

InChI Key

RVTFCTYQXKIXOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19806348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

564.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.840

Distribution Coefficient, logD

2.840

Water Solubility, LogSw

-3.60

Polar Surface Area

72.650

Acid Dissociation Constant (pKa)

14.20

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

44.40

V028-0668 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V028-0668 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0668?
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What is the minimum amount of V028-0668 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0668
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0668
  • 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 V028-0668 available by request