V008-3366 Screening compound: ethyl 1-{4-cyclopentaneamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

V008-3366 Screening compound: ethyl 1-{4-cyclopentaneamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate
V008-3366 Screening compound: ethyl 1-{4-cyclopentaneamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-3366
ethyl 1-{4-cyclopentaneamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

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

V008-3366

Molecular Formula

C28H37N3O5S (C28 H37 N3 O5 S)

Compound Name

ethyl 1-{4-cyclopentaneamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

IUPAC name

ethyl 1-{4-cyclopentaneamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1c(ccc(NC(C1CCCC1)=O)c1)c1S(NC(C)c1ccccc1)(=O)=O)=O

InChI

InChI=1S/C28H37N3O5S/c1-3-36-28(33)23-14-9-17-31(19-23)25-16-15-24(29-27(32)22-12-7-8-13-22)18-26(25)37(34,35)30-20(2)21-10-5-4-6-11-21/h4-6,10-11,15-16,18,20,22-23,30H,3,7-9,12-14,17,19H2,1-2H3,(H,29,32)

InChI Key

UZMYGMUUNCITIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972693

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

527.68

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.670

Distribution Coefficient, logD

4.668

Water Solubility, LogSw

-4.28

Polar Surface Area

88.861

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

1.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

V008-3366 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V008-3366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-3366?
Check Price and Availability of V008-3366, 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 V008-3366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-3366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-3366
  • 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 V008-3366 available by request