8007-1733 Screening compound: 6-[(3,4-dimethoxyphenyl)methyl]-3-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazin-1-yl]-2,5-dihydro-1,2,4-triazin-5-one

8007-1733 Screening compound: 6-[(3,4-dimethoxyphenyl)methyl]-3-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazin-1-yl]-2,5-dihydro-1,2,4-triazin-5-one
8007-1733 Screening compound: 6-[(3,4-dimethoxyphenyl)methyl]-3-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazin-1-yl]-2,5-dihydro-1,2,4-triazin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1733
6-[(3,4-dimethoxyphenyl)methyl]-3-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazin-1-yl]-2,5-dihydro-1,2,4-triazin-5-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

8007-1733

Molecular Formula

C20H20N6O5 (C20 H20 N6 O5)

Compound Name

6-[(3,4-dimethoxyphenyl)methyl]-3-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazin-1-yl]-2,5-dihydro-1,2,4-triazin-5-one

IUPAC name

6-[(34-dimethoxyphenyl)methyl]-3-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazin-1-yl]-25-dihydro-124-triazin-5-one

SMILES

C/C(/c(cc1)ccc1[N+]([O-])=O)=N\NC(NN=C1Cc(cc2)cc(OC)c2OC)=NC1=O

InChI

InChI=1S/C20H20N6O5/c1-12(14-5-7-15(8-6-14)26(28)29)22-24-20-21-19(27)16(23-25-20)10-13-4-9-17(30-2)18(11-13)31-3/h4-9,11H,10H2,1-3H3,(H2,21,24,25,27)

InChI Key

PPSCACWNLRINHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00717305

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.42

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.664

Distribution Coefficient, logD

2.550

Water Solubility, LogSw

-2.99

Polar Surface Area

116.129

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 8007-1733 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1733
  • 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 8007-1733 available by request