3257-3174 Screening compound: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate

3257-3174 Screening compound: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate
3257-3174 Screening compound: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3257-3174
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate

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

3257-3174

Molecular Formula

C30H21N3O5 (C30 H21 N3 O5)

Compound Name

2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate

IUPAC name

2-(4-methyl-3-nitrophenyl)-2-oxoethyl 23-diphenylquinoxaline-6-carboxylate

SMILES

Cc(ccc(C(COC(c1cc2nc(-c3ccccc3)c(-c3ccccc3)nc2cc1)=O)=O)c1)c1[N+]([O-])=O

InChI

InChI=1S/C30H21N3O5/c1-19-12-13-22(17-26(19)33(36)37)27(34)18-38-30(35)23-14-15-24-25(16-23)32-29(21-10-6-3-7-11-21)28(31-24)20-8-4-2-5-9-20/h2-17H,18H2,1H3

InChI Key

MNFGITDROJYXOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01885673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.320

Distribution Coefficient, logD

6.320

Water Solubility, LogSw

-5.57

Polar Surface Area

85.354

Acid Dissociation Constant (pKa)

22.42

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

3257-3174 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 3257-3174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3257-3174?
Check Price and Availability of 3257-3174, 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 3257-3174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3257-3174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3257-3174
  • 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 3257-3174 available by request