3257-3389 Screening compound: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl dibenzo[a,c]phenazine-11-carboxylate

3257-3389 Screening compound: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl dibenzo[a,c]phenazine-11-carboxylate
3257-3389 Screening compound: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl dibenzo[a,c]phenazine-11-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3257-3389
2-(4-methyl-3-nitrophenyl)-2-oxoethyl dibenzo[a,c]phenazine-11-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

3257-3389

Molecular Formula

C30H19N3O5 (C30 H19 N3 O5)

Compound Name

2-(4-methyl-3-nitrophenyl)-2-oxoethyl dibenzo[a,c]phenazine-11-carboxylate

IUPAC name

2-(4-methyl-3-nitrophenyl)-2-oxoethyl 1522-diazapentacyclo[12.8.0.0^{27}.0^{813}.0^{1621}]docosa-1(14)2468(13)91115171921-undecaene-18-carboxylate

SMILES

Cc(ccc(C(COC(c1cc2nc3c(cccc4)c4c(cccc4)c4c3nc2cc1)=O)=O)c1)c1[N+]([O-])=O

InChI

InChI=1S/C30H19N3O5/c1-17-10-11-18(15-26(17)33(36)37)27(34)16-38-30(35)19-12-13-24-25(14-19)32-29-23-9-5-3-7-21(23)20-6-2-4-8-22(20)28(29)31-24/h2-15H,16H2,1H3

InChI Key

NXOQNXBQZJEFBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02109374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.025

Distribution Coefficient, logD

6.024

Water Solubility, LogSw

-5.67

Polar Surface Area

85.354

Acid Dissociation Constant (pKa)

22.42

Base Dissociation Constant (pKb)

4.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

3257-3389 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

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

CORONAVIRUS Library (20774 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3257-3389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3257-3389?
Check Price and Availability of 3257-3389, 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 3257-3389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3257-3389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3257-3389
  • 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 3257-3389 available by request