V022-4709 Screening compound: 4-(3-methylphenyl)-8-(thiophene-2-carbonyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one

V022-4709 Screening compound: 4-(3-methylphenyl)-8-(thiophene-2-carbonyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
V022-4709 Screening compound: 4-(3-methylphenyl)-8-(thiophene-2-carbonyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-4709
4-(3-methylphenyl)-8-(thiophene-2-carbonyl)-1-thia-4,8-diazaspiro[4.5]decan-3-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

V022-4709

Molecular Formula

C19H20N2O2S2 (C19 H20 N2 O2 S2)

Compound Name

4-(3-methylphenyl)-8-(thiophene-2-carbonyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one

IUPAC name

4-(3-methylphenyl)-8-(thiophene-2-carbonyl)-1-thia-48-diazaspiro[4.5]decan-3-one

SMILES

Cc1cccc(N(C(CC2)(CCN2C(c2cccs2)=O)SC2)C2=O)c1

InChI

InChI=1S/C19H20N2O2S2/c1-14-4-2-5-15(12-14)21-17(22)13-25-19(21)7-9-20(10-8-19)18(23)16-6-3-11-24-16/h2-6,11-12H,7-10,13H2,1H3

InChI Key

ZMBABYIRZKKTQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19975113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.213

Distribution Coefficient, logD

3.213

Water Solubility, LogSw

-3.17

Polar Surface Area

33.586

Acid Dissociation Constant (pKa)

16.28

Base Dissociation Constant (pKb)

-1.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

V022-4709 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V022-4709 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-4709?
Check Price and Availability of V022-4709, 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 V022-4709 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-4709
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-4709
  • 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 V022-4709 available by request