Y010-0997 Screening compound: ethyl 3-(4-chlorophenyl)-4-oxo-3,4-dihydropyrazolo[5,1-d][1,2,3,5]tetraazine-8-carboxylate

Y010-0997 Screening compound: ethyl 3-(4-chlorophenyl)-4-oxo-3,4-dihydropyrazolo[5,1-d][1,2,3,5]tetraazine-8-carboxylate
Y010-0997 Screening compound: ethyl 3-(4-chlorophenyl)-4-oxo-3,4-dihydropyrazolo[5,1-d][1,2,3,5]tetraazine-8-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-0997
ethyl 3-(4-chlorophenyl)-4-oxo-3,4-dihydropyrazolo[5,1-d][1,2,3,5]tetraazine-8-carboxylate

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

Y010-0997

Molecular Formula

C13H10ClN5O3 (C13 H10 ClN5 O3)

Compound Name

ethyl 3-(4-chlorophenyl)-4-oxo-3,4-dihydropyrazolo[5,1-d][1,2,3,5]tetraazine-8-carboxylate

IUPAC name

n/a

SMILES

CCOC(c(cnn12)c2N=NN(c(cc2)ccc2Cl)C1=O)=O

InChI

InChI=1S/C13H10ClN5O3/c1-2-22-12(20)10-7-15-19-11(10)16-17-18(13(19)21)9-5-3-8(14)4-6-9/h3-7H,2H2,1H3

InChI Key

IXOKPAVPYISPDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08273236

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.71

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.445

Distribution Coefficient, logD

3.445

Water Solubility, LogSw

-3.71

Polar Surface Area

73.890

Acid Dissociation Constant (pKa)

30.16

Base Dissociation Constant (pKb)

-1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

Y010-0997 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y010-0997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-0997?
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What is the minimum amount of Y010-0997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-0997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-0997
  • 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 Y010-0997 available by request