C075-0246 Screening compound: methyl 2-(2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}acetamido)acetate

C075-0246 Screening compound: methyl 2-(2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}acetamido)acetate
C075-0246 Screening compound: methyl 2-(2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}acetamido)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C075-0246
methyl 2-(2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}acetamido)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

C075-0246

Molecular Formula

C21H20N4O6 (C21 H20 N4 O6)

Compound Name

methyl 2-(2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}acetamido)acetate

IUPAC name

methyl 2-(2-{[3-(4-methoxyphenyl)-4-oxo-34-dihydrophthalazin-1-yl]formamido}acetamido)acetate

SMILES

COC(CNC(CNC(C(c1c2cccc1)=NN(c(cc1)ccc1OC)C2=O)=O)=O)=O

InChI

InChI=1S/C21H20N4O6/c1-30-14-9-7-13(8-10-14)25-21(29)16-6-4-3-5-15(16)19(24-25)20(28)23-11-17(26)22-12-18(27)31-2/h3-10H,11-12H2,1-2H3,(H,22,26)(H,23,28)

InChI Key

RAYKHFZBWIKXNT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14717772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.41

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.393

Distribution Coefficient, logD

1.393

Water Solubility, LogSw

-2.24

Polar Surface Area

103.327

Acid Dissociation Constant (pKa)

12.09

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with C075-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C075-0246?
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What is the minimum amount of C075-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C075-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C075-0246
  • 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 C075-0246 available by request