8008-5333 Screening compound: 4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-[(4-bromophenyl)methylidene]hydrazin-1-yl]-N-(4-methylphenyl)-1,3,5-triazin-2-amine

8008-5333 Screening compound: 4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-[(4-bromophenyl)methylidene]hydrazin-1-yl]-N-(4-methylphenyl)-1,3,5-triazin-2-amine
8008-5333 Screening compound: 4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-[(4-bromophenyl)methylidene]hydrazin-1-yl]-N-(4-methylphenyl)-1,3,5-triazin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-5333
4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-[(4-bromophenyl)methylidene]hydrazin-1-yl]-N-(4-methylphenyl)-1,3,5-triazin-2-amine

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

8008-5333

Molecular Formula

C29H30BrN7 (C29 H30 BrN7)

Compound Name

4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-[(4-bromophenyl)methylidene]hydrazin-1-yl]-N-(4-methylphenyl)-1,3,5-triazin-2-amine

IUPAC name

4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-[(4-bromophenyl)methylidene]hydrazin-1-yl]-N-(4-methylphenyl)-135-triazin-2-amine

SMILES

Cc(cc1)ccc1Nc1nc(N/N=C/c(cc2)ccc2Br)nc(N2CCC(Cc3ccccc3)CC2)n1

InChI

InChI=1S/C29H30BrN7/c1-21-7-13-26(14-8-21)32-27-33-28(36-31-20-24-9-11-25(30)12-10-24)35-29(34-27)37-17-15-23(16-18-37)19-22-5-3-2-4-6-22/h2-14,20,23H,15-19H2,1H3,(H2,32,33,34,35,36)

InChI Key

NQVJHTGXFPJEJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00621229

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

556.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

9.260

Distribution Coefficient, logD

9.260

Water Solubility, LogSw

-6.07

Polar Surface Area

64.530

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

References: we are preparing a list of scientific research reports with 8008-5333 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 8008-5333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-5333
  • 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 8008-5333 available by request