3455-1332 Screening compound: 4-{[3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOL-4-YL]METHYL}-3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOLE

3455-1332 Screening compound: 4-{[3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOL-4-YL]METHYL}-3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOLE
3455-1332 Screening compound: 4-{[3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOL-4-YL]METHYL}-3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOLE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3455-1332
4-{[3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOL-4-YL]METHYL}-3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOLE

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

3455-1332

Molecular Formula

C17H24N4 (C17 H24 N4)

Compound Name

4-{[3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOL-4-YL]METHYL}-3,5-DIMETHYL-1-(PROP-2-EN-1-YL)-1H-PYRAZOLE

IUPAC name

n/a

SMILES

Cc1c(Cc2c(C)n(CC=C)nc2C)c(C)nn1CC=C

InChI

InChI=1S/C17H24N4/c1-7-9-20-14(5)16(12(3)18-20)11-17-13(4)19-21(10-8-2)15(17)6/h7-8H,1-2,9-11H2,3-6H3

InChI Key

XFADURQNHXSHIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01993064

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.4

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.347

Distribution Coefficient, logD

2.347

Water Solubility, LogSw

-1.99

Polar Surface Area

29.030

Acid Dissociation Constant (pKa)

18.59

Base Dissociation Constant (pKb)

3.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

3455-1332 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 3455-1332 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3455-1332?
Check Price and Availability of 3455-1332, 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 3455-1332 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3455-1332
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3455-1332
  • 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 3455-1332 available by request