V021-3728 Screening compound: 4-benzoyl-8-methyl-N-(2-methylpropyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

V021-3728 Screening compound: 4-benzoyl-8-methyl-N-(2-methylpropyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
V021-3728 Screening compound: 4-benzoyl-8-methyl-N-(2-methylpropyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-3728
4-benzoyl-8-methyl-N-(2-methylpropyl)-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

V021-3728

Molecular Formula

C21H30N2O3 (C21 H30 N2 O3)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CNC(C(COC12CCC(C)CC2)N1C(c1ccccc1)=O)=O

InChI

InChI=1S/C21H30N2O3/c1-15(2)13-22-19(24)18-14-26-21(11-9-16(3)10-12-21)23(18)20(25)17-7-5-4-6-8-17/h4-8,15-16,18H,9-14H2,1-3H3,(H,22,24)/t16?,18-,21?/m0/s1

InChI Key

ADFVJCQSPPDISQ-JGCRXCKMSA-N

MDL Number (MFCD)

MFCD19806001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.48

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

3.583

Distribution Coefficient, logD

3.583

Water Solubility, LogSw

-3.64

Polar Surface Area

47.811

Acid Dissociation Constant (pKa)

15.93

Base Dissociation Constant (pKb)

3.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

V021-3728 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V021-3728 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-3728?
Check Price and Availability of V021-3728, 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 V021-3728 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-3728
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-3728
  • 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 V021-3728 available by request