C200-8455 Screening compound: 4-[(2-methoxyphenyl)amino]-2-(4-methylphenyl)pyrazolo[1,5-a]pyrazine-3-carbaldehyde

C200-8455 Screening compound: 4-[(2-methoxyphenyl)amino]-2-(4-methylphenyl)pyrazolo[1,5-a]pyrazine-3-carbaldehyde
C200-8455 Screening compound: 4-[(2-methoxyphenyl)amino]-2-(4-methylphenyl)pyrazolo[1,5-a]pyrazine-3-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-8455
4-[(2-methoxyphenyl)amino]-2-(4-methylphenyl)pyrazolo[1,5-a]pyrazine-3-carbaldehyde

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

C200-8455

Molecular Formula

C21H18N4O2 (C21 H18 N4 O2)

Compound Name

4-[(2-methoxyphenyl)amino]-2-(4-methylphenyl)pyrazolo[1,5-a]pyrazine-3-carbaldehyde

IUPAC name

4-[(2-methoxyphenyl)amino]-2-(4-methylphenyl)pyrazolo[15-a]pyrazine-3-carbaldehyde

SMILES

Cc(cc1)ccc1-c1nn(ccnc2Nc(cccc3)c3OC)c2c1C=O

InChI

InChI=1S/C21H18N4O2/c1-14-7-9-15(10-8-14)19-16(13-26)20-21(22-11-12-25(20)24-19)23-17-5-3-4-6-18(17)27-2/h3-13H,1-2H3,(H,22,23)

InChI Key

XBBKWCHTZFVFHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14728798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.712

Distribution Coefficient, logD

3.709

Water Solubility, LogSw

-3.98

Polar Surface Area

51.079

Acid Dissociation Constant (pKa)

16.39

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

C200-8455 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with C200-8455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-8455?
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What is the minimum amount of C200-8455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-8455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-8455
  • 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 C200-8455 available by request