3257-3179 Screening compound: 2-(4-chlorophenyl)-2-oxoethyl acenaphthyleno[1,2-b]quinoxaline-9-carboxylate

3257-3179 Screening compound: 2-(4-chlorophenyl)-2-oxoethyl acenaphthyleno[1,2-b]quinoxaline-9-carboxylate
3257-3179 Screening compound: 2-(4-chlorophenyl)-2-oxoethyl acenaphthyleno[1,2-b]quinoxaline-9-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3257-3179
2-(4-chlorophenyl)-2-oxoethyl acenaphthyleno[1,2-b]quinoxaline-9-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

3257-3179

Molecular Formula

C27H15ClN2O3 (C27 H15 ClN2 O3)

Compound Name

2-(4-chlorophenyl)-2-oxoethyl acenaphthyleno[1,2-b]quinoxaline-9-carboxylate

IUPAC name

2-(4-chlorophenyl)-2-oxoethyl acenaphthyleno[12-b]quinoxaline-9-carboxylate

SMILES

O=C(COC(c1cc2nc(-c3cccc4cccc-5c34)c5nc2cc1)=O)c(cc1)ccc1Cl

InChI

InChI=1S/C27H15ClN2O3/c28-18-10-7-15(8-11-18)23(31)14-33-27(32)17-9-12-21-22(13-17)30-26-20-6-2-4-16-3-1-5-19(24(16)20)25(26)29-21/h1-13H,14H2

InChI Key

MRWDZOSHDIJBDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01885677

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.600

Distribution Coefficient, logD

6.600

Water Solubility, LogSw

-7.06

Polar Surface Area

52.994

Acid Dissociation Constant (pKa)

22.04

Base Dissociation Constant (pKb)

2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.70

3257-3179 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3257-3179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3257-3179?
Check Price and Availability of 3257-3179, 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 3257-3179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3257-3179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3257-3179
  • 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 3257-3179 available by request