V029-2098 Screening compound: (4-bromophenyl){3-[(Z)-2-butenyloxy]piperidino}methanone

V029-2098 Screening compound: (4-bromophenyl){3-[(Z)-2-butenyloxy]piperidino}methanone
V029-2098 Screening compound: (4-bromophenyl){3-[(Z)-2-butenyloxy]piperidino}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-2098
(4-bromophenyl){3-[(Z)-2-butenyloxy]piperidino}methanone

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

V029-2098

Molecular Formula

C16H20BrNO2 (C16 H20 BrNO2)

Compound Name

(4-bromophenyl){3-[(Z)-2-butenyloxy]piperidino}methanone

IUPAC name

n/a

SMILES

C/C=C\COC(CCC1)CN1C(c(cc1)ccc1Br)=O

InChI

InChI=1S/C16H20BrNO2/c1-2-3-11-20-15-5-4-10-18(12-15)16(19)13-6-8-14(17)9-7-13/h2-3,6-9,15H,4-5,10-12H2,1H3/t15-/m0/s1

InChI Key

JJISSRYEWJFUKO-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD19884730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.417

Distribution Coefficient, logD

3.417

Water Solubility, LogSw

-3.51

Polar Surface Area

23.752

Acid Dissociation Constant (pKa)

26.54

Base Dissociation Constant (pKb)

-3.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

V029-2098 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V029-2098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-2098?
Check Price and Availability of V029-2098, 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 V029-2098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-2098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-2098
  • 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 V029-2098 available by request