7837-0229 Screening compound: propyl 2-{1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetate

7837-0229 Screening compound: propyl 2-{1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetate
7837-0229 Screening compound: propyl 2-{1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7837-0229
propyl 2-{1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-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

7837-0229

Molecular Formula

C18H26N2O5 (C18 H26 N2 O5)

Compound Name

propyl 2-{1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetate

IUPAC name

propyl 2-{1-[(23-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetate

SMILES

CCCOC(CC1N(Cc(cccc2OC)c2OC)CCNC1=O)=O

InChI

InChI=1S/C18H26N2O5/c1-4-10-25-16(21)11-14-18(22)19-8-9-20(14)12-13-6-5-7-15(23-2)17(13)24-3/h5-7,14H,4,8-12H2,1-3H3,(H,19,22)/t14-/m0/s1

InChI Key

ANEIIFAVRMNQJU-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD05666717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.585

Distribution Coefficient, logD

1.426

Water Solubility, LogSw

-2.07

Polar Surface Area

64.487

Acid Dissociation Constant (pKa)

13.48

Base Dissociation Constant (pKb)

7.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

7837-0229 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 7837-0229 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7837-0229?
Check Price and Availability of 7837-0229, 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 7837-0229 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7837-0229
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7837-0229
  • 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 7837-0229 available by request