C798-1208 Screening compound: 1-(2-methoxyphenyl)-3-{[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}urea

C798-1208 Screening compound: 1-(2-methoxyphenyl)-3-{[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}urea
C798-1208 Screening compound: 1-(2-methoxyphenyl)-3-{[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C798-1208
1-(2-methoxyphenyl)-3-{[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}urea

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

C798-1208

Molecular Formula

C23H23N5O2 (C23 H23 N5 O2)

Compound Name

1-(2-methoxyphenyl)-3-{[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}urea

IUPAC name

1-(2-methoxyphenyl)-3-{[3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}urea

SMILES

Cc(c(CNC(Nc(cccc1)c1OC)=O)c1-n2cccc2)nn1-c1ccccc1

InChI

InChI=1S/C23H23N5O2/c1-17-19(16-24-23(29)25-20-12-6-7-13-21(20)30-2)22(27-14-8-9-15-27)28(26-17)18-10-4-3-5-11-18/h3-15H,16H2,1-2H3,(H2,24,25,29)

InChI Key

TYKGSPBWIPGCFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14799249

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.069

Distribution Coefficient, logD

4.069

Water Solubility, LogSw

-4.27

Polar Surface Area

58.006

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

C798-1208 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

SH2 Library (10483 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C798-1208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C798-1208?
Check Price and Availability of C798-1208, 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 C798-1208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C798-1208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C798-1208
  • 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 C798-1208 available by request