V017-9467 Screening compound: ethyl 1-{[1-[(butylamino)carbonyl]-6-(3-methylphenyl)-3-piperidyl]carbonyl}-3-piperidinecarboxylate

V017-9467 Screening compound: ethyl 1-{[1-[(butylamino)carbonyl]-6-(3-methylphenyl)-3-piperidyl]carbonyl}-3-piperidinecarboxylate
V017-9467 Screening compound: ethyl 1-{[1-[(butylamino)carbonyl]-6-(3-methylphenyl)-3-piperidyl]carbonyl}-3-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-9467
ethyl 1-{[1-[(butylamino)carbonyl]-6-(3-methylphenyl)-3-piperidyl]carbonyl}-3-piperidinecarboxylate

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

V017-9467

Molecular Formula

C26H39N3O4 (C26 H39 N3 O4)

Compound Name

ethyl 1-{[1-[(butylamino)carbonyl]-6-(3-methylphenyl)-3-piperidyl]carbonyl}-3-piperidinecarboxylate

IUPAC name

ethyl 1-[1-(butylcarbamoyl)-6-(3-methylphenyl)piperidine-3-carbonyl]piperidine-3-carboxylate

SMILES

CCCCNC(N(CC(CC1)C(N(CCC2)CC2C(OCC)=O)=O)C1c1cc(C)ccc1)=O

InChI

InChI=1S/C26H39N3O4/c1-4-6-14-27-26(32)29-18-21(12-13-23(29)20-10-7-9-19(3)16-20)24(30)28-15-8-11-22(17-28)25(31)33-5-2/h7,9-10,16,21-23H,4-6,8,11-15,17-18H2,1-3H3,(H,27,32)

InChI Key

BGUSLDGJCZWNKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19898287

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.945

Distribution Coefficient, logD

4.945

Water Solubility, LogSw

-4.59

Polar Surface Area

63.834

Acid Dissociation Constant (pKa)

16.96

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

65.39

References: we are preparing a list of scientific research reports with V017-9467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-9467?
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What is the minimum amount of V017-9467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-9467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-9467
  • 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 V017-9467 available by request