8009-0666 Screening compound: 4-[(E)-{2-[4-(4-benzylpiperidin-1-yl)-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-5-bromo-2-methoxyphenol

8009-0666 Screening compound: 4-[(E)-{2-[4-(4-benzylpiperidin-1-yl)-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-5-bromo-2-methoxyphenol
8009-0666 Screening compound: 4-[(E)-{2-[4-(4-benzylpiperidin-1-yl)-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-5-bromo-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-0666
4-[(E)-{2-[4-(4-benzylpiperidin-1-yl)-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-5-bromo-2-methoxyphenol

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

8009-0666

Molecular Formula

C30H32BrN7O3 (C30 H32 BrN7 O3)

Compound Name

4-[(E)-{2-[4-(4-benzylpiperidin-1-yl)-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-5-bromo-2-methoxyphenol

IUPAC name

4-[(E)-{2-[4-(4-benzylpiperidin-1-yl)-6-[(4-methoxyphenyl)amino]-135-triazin-2-yl]hydrazin-1-ylidene}methyl]-5-bromo-2-methoxyphenol

SMILES

COc(cc1)ccc1Nc1nc(N/N=C/c(cc(c(O)c2)OC)c2Br)nc(N2CCC(Cc3ccccc3)CC2)n1

InChI

InChI=1S/C30H32BrN7O3/c1-40-24-10-8-23(9-11-24)33-28-34-29(37-32-19-22-17-27(41-2)26(39)18-25(22)31)36-30(35-28)38-14-12-21(13-15-38)16-20-6-4-3-5-7-20/h3-11,17-19,21,39H,12-16H2,1-2H3,(H2,33,34,35,36,37)

InChI Key

DIXQFXURYBSCBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01036106

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

618.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

8.160

Distribution Coefficient, logD

8.142

Water Solubility, LogSw

-5.70

Polar Surface Area

96.253

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

4.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with 8009-0666 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-0666?
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What is the minimum amount of 8009-0666 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-0666
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-0666
  • 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 8009-0666 available by request