D474-0062 Screening compound: N-{3-[4-(4-chlorophenyl)-1-methyl-3-oxo-2-phenyl-1H,2H,3H,5H-pyrrolo[3,4-c]pyrazol-5-yl]phenyl}acetamide

D474-0062 Screening compound: N-{3-[4-(4-chlorophenyl)-1-methyl-3-oxo-2-phenyl-1H,2H,3H,5H-pyrrolo[3,4-c]pyrazol-5-yl]phenyl}acetamide
D474-0062 Screening compound: N-{3-[4-(4-chlorophenyl)-1-methyl-3-oxo-2-phenyl-1H,2H,3H,5H-pyrrolo[3,4-c]pyrazol-5-yl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D474-0062
N-{3-[4-(4-chlorophenyl)-1-methyl-3-oxo-2-phenyl-1H,2H,3H,5H-pyrrolo[3,4-c]pyrazol-5-yl]phenyl}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

D474-0062

Molecular Formula

C26H21ClN4O2 (C26 H21 ClN4 O2)

Compound Name

N-{3-[4-(4-chlorophenyl)-1-methyl-3-oxo-2-phenyl-1H,2H,3H,5H-pyrrolo[3,4-c]pyrazol-5-yl]phenyl}acetamide

IUPAC name

N-{3-[4-(4-chlorophenyl)-1-methyl-3-oxo-2-phenyl-1H2H3H5H-pyrrolo[34-c]pyrazol-5-yl]phenyl}acetamide

SMILES

CC(Nc1cccc(-n(cc2N(C)N3c4ccccc4)c(-c(cc4)ccc4Cl)c2C3=O)c1)=O

InChI

InChI=1S/C26H21ClN4O2/c1-17(32)28-20-7-6-10-22(15-20)30-16-23-24(25(30)18-11-13-19(27)14-12-18)26(33)31(29(23)2)21-8-4-3-5-9-21/h3-16H,1-2H3,(H,28,32)

InChI Key

GPIQNOGFLDLXTB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14830881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.93

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.554

Distribution Coefficient, logD

4.554

Water Solubility, LogSw

-4.95

Polar Surface Area

44.628

Acid Dissociation Constant (pKa)

14.05

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

D474-0062 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D474-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D474-0062?
Check Price and Availability of D474-0062, 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 D474-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D474-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D474-0062
  • 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 D474-0062 available by request