Y505-5453 Screening compound: 4-[4-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5-YL]-2-METHOXYPHENYL METHYL ETHER

Y505-5453 Screening compound: 4-[4-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5-YL]-2-METHOXYPHENYL METHYL ETHER
Y505-5453 Screening compound: 4-[4-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5-YL]-2-METHOXYPHENYL METHYL ETHER alternative view

Chemical Structure Depiction of ChemDiv screening compound Y505-5453
4-[4-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5-YL]-2-METHOXYPHENYL METHYL ETHER

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

Y505-5453

Molecular Formula

C28H29ClN2O4 (C28 H29 ClN2 O4)

Compound Name

4-[4-CHLORO-3-(3,4-DIMETHOXYPHENYL)-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5-YL]-2-METHOXYPHENYL METHYL ETHER

IUPAC name

n/a

SMILES

Cc1cc(Cn(c(-c(cc2)cc(OC)c2OC)c2Cl)nc2-c(cc2)cc(OC)c2OC)c(C)cc1

InChI

InChI=1S/C28H29ClN2O4/c1-17-7-8-18(2)21(13-17)16-31-28(20-10-12-23(33-4)25(15-20)35-6)26(29)27(30-31)19-9-11-22(32-3)24(14-19)34-5/h7-15H,16H2,1-6H3

InChI Key

BUECCXONPCBAIO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.313

Distribution Coefficient, logD

6.313

Water Solubility, LogSw

-6.59

Polar Surface Area

43.722

Acid Dissociation Constant (pKa)

27.92

Base Dissociation Constant (pKb)

0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with Y505-5453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y505-5453?
Check Price and Availability of Y505-5453, 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 Y505-5453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y505-5453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y505-5453
  • 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 Y505-5453 available by request