Y070-1116 Screening compound: N-(3-chlorophenyl)-2-[1-(furan-2-carbonyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide

Y070-1116 Screening compound: N-(3-chlorophenyl)-2-[1-(furan-2-carbonyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide
Y070-1116 Screening compound: N-(3-chlorophenyl)-2-[1-(furan-2-carbonyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-1116
N-(3-chlorophenyl)-2-[1-(furan-2-carbonyl)-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

Y070-1116

Molecular Formula

C21H16ClN3O4 (C21 H16 ClN3 O4)

Compound Name

N-(3-chlorophenyl)-2-[1-(furan-2-carbonyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide

IUPAC name

N-(3-chlorophenyl)-2-[1-(furan-2-carbonyl)-3-oxo-1234-tetrahydroquinoxalin-2-yl]acetamide

SMILES

O=C(CC1N(C(c2ccco2)=O)c(cccc2)c2NC1=O)Nc1cccc(Cl)c1

InChI

InChI=1S/C21H16ClN3O4/c22-13-5-3-6-14(11-13)23-19(26)12-17-20(27)24-15-7-1-2-8-16(15)25(17)21(28)18-9-4-10-29-18/h1-11,17H,12H2,(H,23,26)(H,24,27)/t17-/m0/s1

InChI Key

PVVGDVGJEUCVOG-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD03463606

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.83

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.142

Distribution Coefficient, logD

3.140

Water Solubility, LogSw

-3.46

Polar Surface Area

71.088

Acid Dissociation Constant (pKa)

9.77

Base Dissociation Constant (pKb)

-0.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.50

Y070-1116 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with Y070-1116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-1116?
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What is the minimum amount of Y070-1116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1116
  • 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 Y070-1116 available by request