V016-8903 Screening compound: 2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-methoxybenzoyl)piperidin-4-yl]-N-propylacetamide

V016-8903 Screening compound: 2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-methoxybenzoyl)piperidin-4-yl]-N-propylacetamide
V016-8903 Screening compound: 2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-methoxybenzoyl)piperidin-4-yl]-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-8903
2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-methoxybenzoyl)piperidin-4-yl]-N-propylacetamide

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

V016-8903

Molecular Formula

C26H31N3O6 (C26 H31 N3 O6)

Compound Name

2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-methoxybenzoyl)piperidin-4-yl]-N-propylacetamide

IUPAC name

2-[(2H-13-benzodioxol-5-yl)formamido]-2-[1-(4-methoxybenzoyl)piperidin-4-yl]-N-propylacetamide

SMILES

CCCNC(C(C(CC1)CCN1C(c(cc1)ccc1OC)=O)NC(c(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C26H31N3O6/c1-3-12-27-25(31)23(28-24(30)19-6-9-21-22(15-19)35-16-34-21)17-10-13-29(14-11-17)26(32)18-4-7-20(33-2)8-5-18/h4-9,15,17,23H,3,10-14,16H2,1-2H3,(H,27,31)(H,28,30)/t23-/m0/s1

InChI Key

DGZDEGCWQGPCPX-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19875151

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.659

Distribution Coefficient, logD

2.659

Water Solubility, LogSw

-3.07

Polar Surface Area

89.838

Acid Dissociation Constant (pKa)

12.85

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.30

References: we are preparing a list of scientific research reports with V016-8903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-8903?
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What is the minimum amount of V016-8903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-8903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-8903
  • 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 V016-8903 available by request