Y030-5994 Screening compound: (3,4-diethoxyphenyl)(4-ethylpiperazino)methanone

Y030-5994 Screening compound: (3,4-diethoxyphenyl)(4-ethylpiperazino)methanone
Y030-5994 Screening compound: (3,4-diethoxyphenyl)(4-ethylpiperazino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-5994
(3,4-diethoxyphenyl)(4-ethylpiperazino)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

Y030-5994

Molecular Formula

C17H26N2O3 (C17 H26 N2 O3)

Compound Name

(3,4-diethoxyphenyl)(4-ethylpiperazino)methanone

IUPAC name

1-(34-diethoxybenzoyl)-4-ethylpiperazine

SMILES

CCN(CC1)CCN1C(c(cc1)cc(OCC)c1OCC)=O

InChI

InChI=1S/C17H26N2O3/c1-4-18-9-11-19(12-10-18)17(20)14-7-8-15(21-5-2)16(13-14)22-6-3/h7-8,13H,4-6,9-12H2,1-3H3

InChI Key

UOJZCXSPBDJLPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03575623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.296

Distribution Coefficient, logD

1.120

Water Solubility, LogSw

-2.07

Polar Surface Area

34.844

Acid Dissociation Constant (pKa)

28.84

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

Y030-5994 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y030-5994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-5994?
Check Price and Availability of Y030-5994, 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 Y030-5994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-5994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-5994
  • 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 Y030-5994 available by request