V017-8254 Screening compound: N~3~-{(1R,2R)-2-[(2-methylbenzoyl)amino]cyclohexyl}-1-octanoyl-3-piperidinecarboxamide

V017-8254 Screening compound: N~3~-{(1R,2R)-2-[(2-methylbenzoyl)amino]cyclohexyl}-1-octanoyl-3-piperidinecarboxamide
V017-8254 Screening compound: N~3~-{(1R,2R)-2-[(2-methylbenzoyl)amino]cyclohexyl}-1-octanoyl-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-8254
N~3~-{(1R,2R)-2-[(2-methylbenzoyl)amino]cyclohexyl}-1-octanoyl-3-piperidinecarboxamide

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

V017-8254

Molecular Formula

C28H43N3O3 (C28 H43 N3 O3)

Compound Name

N~3~-{(1R,2R)-2-[(2-methylbenzoyl)amino]cyclohexyl}-1-octanoyl-3-piperidinecarboxamide

IUPAC name

N-[(1R2R)-2-(2-methylbenzamido)cyclohexyl]-1-octanoylpiperidine-3-carboxamide

SMILES

CCCCCCCC(N(CCC1)CC1C(N[C@@H](CCCC1)[C@H]1NC(c1c(C)cccc1)=O)=O)=O

InChI

InChI=1S/C28H43N3O3/c1-3-4-5-6-7-18-26(32)31-19-12-14-22(20-31)27(33)29-24-16-10-11-17-25(24)30-28(34)23-15-9-8-13-21(23)2/h8-9,13,15,22,24-25H,3-7,10-12,14,16-20H2,1-2H3,(H,29,33)(H,30,34)/t22?,24-,25-/m0/s1

InChI Key

JFJHPGZKSXHIGT-GARJWBAXSA-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

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.964

Distribution Coefficient, logD

4.964

Water Solubility, LogSw

-4.58

Polar Surface Area

65.430

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

-0.26

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

67.86

References: we are preparing a list of scientific research reports with V017-8254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-8254?
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What is the minimum amount of V017-8254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-8254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-8254
  • 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 V017-8254 available by request