C094-0480 Screening compound: N~1~-(4-isopropylphenyl)-2-[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]-2-phenylacetamide

C094-0480 Screening compound: N~1~-(4-isopropylphenyl)-2-[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]-2-phenylacetamide
C094-0480 Screening compound: N~1~-(4-isopropylphenyl)-2-[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-0480
N~1~-(4-isopropylphenyl)-2-[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]-2-phenylacetamide

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

C094-0480

Molecular Formula

C25H25N3O2 (C25 H25 N3 O2)

Compound Name

N~1~-(4-isopropylphenyl)-2-[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]-2-phenylacetamide

IUPAC name

n/a

SMILES

CC(C)c(cc1)ccc1NC(C(c1ccccc1)N(C1)c(cccc2)c2NC1=O)=O

InChI

InChI=1S/C25H25N3O2/c1-17(2)18-12-14-20(15-13-18)26-25(30)24(19-8-4-3-5-9-19)28-16-23(29)27-21-10-6-7-11-22(21)28/h3-15,17,24H,16H2,1-2H3,(H,26,30)(H,27,29)/t24-/m1/s1

InChI Key

CBOBFTJZIOZMDZ-XMMPIXPASA-N

MDL Number (MFCD)

MFCD03449848

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.152

Distribution Coefficient, logD

5.152

Water Solubility, LogSw

-4.99

Polar Surface Area

49.853

Acid Dissociation Constant (pKa)

11.47

Base Dissociation Constant (pKb)

1.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

6.00

C094-0480 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C094-0480 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-0480?
Check Price and Availability of C094-0480, 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 C094-0480 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-0480
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-0480
  • 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 C094-0480 available by request