8003-2751 Screening compound: 4-({(E)-2-[2-(2-isopropyl-5-methylphenoxy)acetyl]hydrazono}methyl)-2-methoxy-3-nitrophenyl acetate

8003-2751 Screening compound: 4-({(E)-2-[2-(2-isopropyl-5-methylphenoxy)acetyl]hydrazono}methyl)-2-methoxy-3-nitrophenyl acetate
8003-2751 Screening compound: 4-({(E)-2-[2-(2-isopropyl-5-methylphenoxy)acetyl]hydrazono}methyl)-2-methoxy-3-nitrophenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-2751
4-({(E)-2-[2-(2-isopropyl-5-methylphenoxy)acetyl]hydrazono}methyl)-2-methoxy-3-nitrophenyl acetate

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

8003-2751

Molecular Formula

C22H25N3O7 (C22 H25 N3 O7)

Compound Name

4-({(E)-2-[2-(2-isopropyl-5-methylphenoxy)acetyl]hydrazono}methyl)-2-methoxy-3-nitrophenyl acetate

IUPAC name

2-methoxy-4-[(E)-({2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}imino)methyl]-3-nitrophenyl acetate

SMILES

CC(C)c(ccc(C)c1)c1OCC(N/N=C/c(c([N+]([O-])=O)c1OC)ccc1OC(C)=O)=O

InChI

InChI=1S/C22H25N3O7/c1-13(2)17-8-6-14(3)10-19(17)31-12-20(27)24-23-11-16-7-9-18(32-15(4)26)22(30-5)21(16)25(28)29/h6-11,13H,12H2,1-5H3,(H,24,27)

InChI Key

UAEJLXCKNQMTFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00743453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.46

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.743

Distribution Coefficient, logD

4.741

Water Solubility, LogSw

-4.69

Polar Surface Area

104.261

Acid Dissociation Constant (pKa)

9.73

Base Dissociation Constant (pKb)

2.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.82

References: we are preparing a list of scientific research reports with 8003-2751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-2751?
Check Price and Availability of 8003-2751, 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 8003-2751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-2751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-2751
  • 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 8003-2751 available by request