Y070-0995 Screening compound: N-(2-ethoxyphenyl)-2-[1-(3-nitrobenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide

Y070-0995 Screening compound: N-(2-ethoxyphenyl)-2-[1-(3-nitrobenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide
Y070-0995 Screening compound: N-(2-ethoxyphenyl)-2-[1-(3-nitrobenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0995
N-(2-ethoxyphenyl)-2-[1-(3-nitrobenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide

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

Y070-0995

Molecular Formula

C25H22N4O6 (C25 H22 N4 O6)

Compound Name

N-(2-ethoxyphenyl)-2-[1-(3-nitrobenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide

IUPAC name

N-(2-ethoxyphenyl)-2-[1-(3-nitrobenzoyl)-3-oxo-1234-tetrahydroquinoxalin-2-yl]acetamide

SMILES

CCOc(cccc1)c1NC(CC1N(C(c2cccc([N+]([O-])=O)c2)=O)c(cccc2)c2NC1=O)=O

InChI

InChI=1S/C25H22N4O6/c1-2-35-22-13-6-4-11-19(22)26-23(30)15-21-24(31)27-18-10-3-5-12-20(18)28(21)25(32)16-8-7-9-17(14-16)29(33)34/h3-14,21H,2,15H2,1H3,(H,26,30)(H,27,31)/t21-/m0/s1

InChI Key

YLKFRFVCJKSWPI-NRFANRHFSA-N

MDL Number (MFCD)

MFCD03212484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.47

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.155

Distribution Coefficient, logD

3.155

Water Solubility, LogSw

-3.50

Polar Surface Area

102.404

Acid Dissociation Constant (pKa)

10.22

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

Y070-0995 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y070-0995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0995?
Check Price and Availability of Y070-0995, 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 Y070-0995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0995
  • 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 Y070-0995 available by request