Y070-0919 Screening compound: 2-[1-(4-tert-butylbenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]-N-(4-chlorophenyl)acetamide

Y070-0919 Screening compound: 2-[1-(4-tert-butylbenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]-N-(4-chlorophenyl)acetamide
Y070-0919 Screening compound: 2-[1-(4-tert-butylbenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]-N-(4-chlorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0919
2-[1-(4-tert-butylbenzoyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl]-N-(4-chlorophenyl)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

Y070-0919

Molecular Formula

C27H26ClN3O3 (C27 H26 ClN3 O3)

Compound Name

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

IUPAC name

2-[1-(4-tert-butylbenzoyl)-3-oxo-1234-tetrahydroquinoxalin-2-yl]-N-(4-chlorophenyl)acetamide

SMILES

CC(C)(C)c(cc1)ccc1C(N(C1CC(Nc(cc2)ccc2Cl)=O)c(cccc2)c2NC1=O)=O

InChI

InChI=1S/C27H26ClN3O3/c1-27(2,3)18-10-8-17(9-11-18)26(34)31-22-7-5-4-6-21(22)30-25(33)23(31)16-24(32)29-20-14-12-19(28)13-15-20/h4-15,23H,16H2,1-3H3,(H,29,32)(H,30,33)/t23-/m0/s1

InChI Key

RJOBUIFYSMPZTA-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD03212396

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.97

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.508

Distribution Coefficient, logD

5.506

Water Solubility, LogSw

-5.97

Polar Surface Area

62.510

Acid Dissociation Constant (pKa)

9.85

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

Y070-0919 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with Y070-0919 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0919?
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What is the minimum amount of Y070-0919 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0919
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0919
  • 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 Y070-0919 available by request