V005-9062 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(2-phenylacetyl)piperazin-1-yl]benzene-1-sulfonamide

V005-9062 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(2-phenylacetyl)piperazin-1-yl]benzene-1-sulfonamide
V005-9062 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(2-phenylacetyl)piperazin-1-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-9062
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(2-phenylacetyl)piperazin-1-yl]benzene-1-sulfonamide

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

V005-9062

Molecular Formula

C30H37N3O6S (C30 H37 N3 O6 S)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(2-phenylacetyl)piperazin-1-yl]benzene-1-sulfonamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(2-phenylacetyl)piperazin-1-yl]benzene-1-sulfonamide

SMILES

CN(CCc(cc1)cc(OC)c1OC)S(c(cc1)cc(N(CC2)CCN2C(Cc2ccccc2)=O)c1OC)(=O)=O

InChI

InChI=1S/C30H37N3O6S/c1-31(15-14-24-10-12-28(38-3)29(20-24)39-4)40(35,36)25-11-13-27(37-2)26(22-25)32-16-18-33(19-17-32)30(34)21-23-8-6-5-7-9-23/h5-13,20,22H,14-19,21H2,1-4H3

InChI Key

JNALWCDPABWEEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19950609

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

567.71

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.104

Distribution Coefficient, logD

4.104

Water Solubility, LogSw

-4.31

Polar Surface Area

74.753

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.70

V005-9062 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V005-9062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-9062?
Check Price and Availability of V005-9062, 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 V005-9062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-9062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-9062
  • 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 V005-9062 available by request