V004-4325 Screening compound: N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)-2-methoxyacetamide

V004-4325 Screening compound: N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)-2-methoxyacetamide
V004-4325 Screening compound: N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)-2-methoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-4325
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)-2-methoxyacetamide

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

V004-4325

Molecular Formula

C27H29FN4O6S (C27 H29 FN4 O6 S)

Compound Name

N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)-2-methoxyacetamide

IUPAC name

N-(3-{[(2H-13-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)-2-methoxyacetamide

SMILES

COCC(Nc(cc1)cc(S(NCc(cc2)cc3c2OCO3)(=O)=O)c1N(CC1)CCN1c(cccc1)c1F)=O

InChI

InChI=1S/C27H29FN4O6S/c1-36-17-27(33)30-20-7-8-23(32-12-10-31(11-13-32)22-5-3-2-4-21(22)28)26(15-20)39(34,35)29-16-19-6-9-24-25(14-19)38-18-37-24/h2-9,14-15,29H,10-13,16-18H2,1H3,(H,30,33)

InChI Key

BOUVAJAAHDPCDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972598

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

556.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.061

Distribution Coefficient, logD

4.061

Water Solubility, LogSw

-4.14

Polar Surface Area

96.796

Acid Dissociation Constant (pKa)

10.40

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with V004-4325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-4325?
Check Price and Availability of V004-4325, 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 V004-4325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-4325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-4325
  • 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 V004-4325 available by request