V009-5383 Screening compound: 2-[4-({2-[4-(naphthalene-1-sulfonyl)piperazin-1-yl]-6-oxo-1,6-dihydropyrimidin-4-yl}methyl)piperazin-1-yl]benzonitrile

V009-5383 Screening compound: 2-[4-({2-[4-(naphthalene-1-sulfonyl)piperazin-1-yl]-6-oxo-1,6-dihydropyrimidin-4-yl}methyl)piperazin-1-yl]benzonitrile
V009-5383 Screening compound: 2-[4-({2-[4-(naphthalene-1-sulfonyl)piperazin-1-yl]-6-oxo-1,6-dihydropyrimidin-4-yl}methyl)piperazin-1-yl]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-5383
2-[4-({2-[4-(naphthalene-1-sulfonyl)piperazin-1-yl]-6-oxo-1,6-dihydropyrimidin-4-yl}methyl)piperazin-1-yl]benzonitrile

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

V009-5383

Molecular Formula

C30H31N7O3S (C30 H31 N7 O3 S)

Compound Name

2-[4-({2-[4-(naphthalene-1-sulfonyl)piperazin-1-yl]-6-oxo-1,6-dihydropyrimidin-4-yl}methyl)piperazin-1-yl]benzonitrile

IUPAC name

2-[4-({2-[4-(naphthalene-1-sulfonyl)piperazin-1-yl]-6-oxo-16-dihydropyrimidin-4-yl}methyl)piperazin-1-yl]benzonitrile

SMILES

N#Cc(cccc1)c1N1CCN(CC(N=C(N2)N(CC3)CCN3S(c3cccc4ccccc34)(=O)=O)=CC2=O)CC1

InChI

InChI=1S/C30H31N7O3S/c31-21-24-7-2-4-10-27(24)35-14-12-34(13-15-35)22-25-20-29(38)33-30(32-25)36-16-18-37(19-17-36)41(39,40)28-11-5-8-23-6-1-3-9-26(23)28/h1-11,20H,12-19,22H2,(H,32,33,38)

InChI Key

VBUBWCOVECFKHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19860023

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

569.69

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.849

Distribution Coefficient, logD

1.816

Water Solubility, LogSw

-3.62

Polar Surface Area

93.358

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

8.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

V009-5383 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 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 V009-5383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-5383?
Check Price and Availability of V009-5383, 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 V009-5383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-5383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-5383
  • 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 V009-5383 available by request