V019-5913 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl acetate

V019-5913 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl acetate
V019-5913 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-5913
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl acetate

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

V019-5913

Molecular Formula

C18H23NO5 (C18 H23 NO5)

Compound Name

1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl acetate

IUPAC name

(2S)-1-{4-[(2H-13-benzodioxol-5-yl)methyl]piperidin-1-yl}-1-oxopropan-2-yl acetate

SMILES

C[C@@H](C(N1CCC(Cc(cc2)cc3c2OCO3)CC1)=O)OC(C)=O

InChI

InChI=1S/C18H23NO5/c1-12(24-13(2)20)18(21)19-7-5-14(6-8-19)9-15-3-4-16-17(10-15)23-11-22-16/h3-4,10,12,14H,5-9,11H2,1-2H3/t12-/m0/s1

InChI Key

NRRZWPXILYGNBR-LBPRGKRZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.737

Distribution Coefficient, logD

2.737

Water Solubility, LogSw

-2.95

Polar Surface Area

54.523

Acid Dissociation Constant (pKa)

24.24

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

V019-5913 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V019-5913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-5913?
Check Price and Availability of V019-5913, 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 V019-5913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-5913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-5913
  • 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 V019-5913 available by request