Y041-4764 Screening compound: 1-hydroxy-2-[5-(4-hydroxy-3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-methyl-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one

Y041-4764 Screening compound: 1-hydroxy-2-[5-(4-hydroxy-3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-methyl-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one
Y041-4764 Screening compound: 1-hydroxy-2-[5-(4-hydroxy-3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-methyl-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4764
1-hydroxy-2-[5-(4-hydroxy-3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-methyl-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one

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

Y041-4764

Molecular Formula

C24H24N2O5 (C24 H24 N2 O5)

Compound Name

1-hydroxy-2-[5-(4-hydroxy-3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-methyl-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one

IUPAC name

1-hydroxy-2-[5-(4-hydroxy-3-methoxyphenyl)-45-dihydro-1H-pyrazol-3-yl]-3-methyl-6H7H8H9H10H-cyclohexa[c]chromen-6-one

SMILES

Cc1cc(OC(C2=C3CCCC2)=O)c3c(O)c1C(C1)=NNC1c(cc1)cc(OC)c1O

InChI

InChI=1S/C24H24N2O5/c1-12-9-20-22(14-5-3-4-6-15(14)24(29)31-20)23(28)21(12)17-11-16(25-26-17)13-7-8-18(27)19(10-13)30-2/h7-10,16,25,27-28H,3-6,11H2,1-2H3/t16-/m1/s1

InChI Key

LKELZSHJFWIVCP-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD12199196

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.202

Distribution Coefficient, logD

4.055

Water Solubility, LogSw

-4.16

Polar Surface Area

85.059

Acid Dissociation Constant (pKa)

7.80

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

Y041-4764 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y041-4764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4764?
Check Price and Availability of Y041-4764, 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 Y041-4764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4764
  • 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 Y041-4764 available by request