V017-8810 Screening compound: 1-(2-ethylhexanoyl)-N-[2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide

V017-8810 Screening compound: 1-(2-ethylhexanoyl)-N-[2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide
V017-8810 Screening compound: 1-(2-ethylhexanoyl)-N-[2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-8810
1-(2-ethylhexanoyl)-N-[2-(2-methylbenzamido)cyclohexyl]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

V017-8810

Molecular Formula

C28H43N3O3 (C28 H43 N3 O3)

Compound Name

1-(2-ethylhexanoyl)-N-[2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide

IUPAC name

1-(2-ethylhexanoyl)-N-[(1R2R)-2-(2-methylbenzamido)cyclohexyl]piperidine-4-carboxamide

SMILES

CCCCC(CC)C(N(CC1)CCC1C(N[C@@H](CCCC1)[C@H]1NC(c1c(C)cccc1)=O)=O)=O

InChI

InChI=1S/C28H43N3O3/c1-4-6-12-21(5-2)28(34)31-18-16-22(17-19-31)26(32)29-24-14-9-10-15-25(24)30-27(33)23-13-8-7-11-20(23)3/h7-8,11,13,21-22,24-25H,4-6,9-10,12,14-19H2,1-3H3,(H,29,32)(H,30,33)/t21?,24-,25-/m0/s1

InChI Key

UTYLDAGNEJOMNU-MHKYCTGGSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.67

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.790

Distribution Coefficient, logD

4.790

Water Solubility, LogSw

-4.61

Polar Surface Area

66.024

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

0.95

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

67.86

V017-8810 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V017-8810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-8810?
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What is the minimum amount of V017-8810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-8810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-8810
  • 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 V017-8810 available by request