V008-3399 Screening compound: 1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-pentanamidophenyl)piperidine-4-carboxamide

V008-3399 Screening compound: 1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-pentanamidophenyl)piperidine-4-carboxamide
V008-3399 Screening compound: 1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-pentanamidophenyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-3399
1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-pentanamidophenyl)piperidine-4-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

V008-3399

Molecular Formula

C27H38N4O6S (C27 H38 N4 O6 S)

Compound Name

1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-pentanamidophenyl)piperidine-4-carboxamide

IUPAC name

1-(2-{[2-(34-dimethoxyphenyl)ethyl]sulfamoyl}-4-pentanamidophenyl)piperidine-4-carboxamide

SMILES

CCCCC(Nc(cc1)cc(S(NCCc(cc2)cc(OC)c2OC)(=O)=O)c1N(CC1)CCC1C(N)=O)=O

InChI

InChI=1S/C27H38N4O6S/c1-4-5-6-26(32)30-21-8-9-22(31-15-12-20(13-16-31)27(28)33)25(18-21)38(34,35)29-14-11-19-7-10-23(36-2)24(17-19)37-3/h7-10,17-18,20,29H,4-6,11-16H2,1-3H3,(H2,28,33)(H,30,32)

InChI Key

AYYIBCAOVOOJSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972745

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

546.69

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.756

Distribution Coefficient, logD

2.755

Water Solubility, LogSw

-3.52

Polar Surface Area

117.459

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.10

V008-3399 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V008-3399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-3399?
Check Price and Availability of V008-3399, 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 V008-3399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-3399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-3399
  • 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 V008-3399 available by request