G598-0600 Screening compound: 2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(1-phenylethyl)acetamide

G598-0600 Screening compound: 2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(1-phenylethyl)acetamide
G598-0600 Screening compound: 2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(1-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G598-0600
2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(1-phenylethyl)acetamide

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

G598-0600

Molecular Formula

C26H23ClN6O2 (C26 H23 ClN6 O2)

Compound Name

2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(1-phenylethyl)acetamide

IUPAC name

2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2H4H5H-pyrazolo[34-d]pyridazin-5-yl]-N-(1-phenylethyl)acetamide

SMILES

CC(c1ccccc1)NC(CN(C(c1c2-n3cccc3)=O)N=C(C)c1nn2-c(cc1)ccc1Cl)=O

InChI

InChI=1S/C26H23ClN6O2/c1-17(19-8-4-3-5-9-19)28-22(34)16-32-26(35)23-24(18(2)29-32)30-33(21-12-10-20(27)11-13-21)25(23)31-14-6-7-15-31/h3-15,17H,16H2,1-2H3,(H,28,34)/t17-/m0/s1

InChI Key

DTVDTXAEGIQJRA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD15022107

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.351

Distribution Coefficient, logD

4.351

Water Solubility, LogSw

-4.95

Polar Surface Area

67.768

Acid Dissociation Constant (pKa)

13.60

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with G598-0600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G598-0600?
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What is the minimum amount of G598-0600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G598-0600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G598-0600
  • 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 G598-0600 available by request