0873-0068 Screening compound: 2-[(E)-{2-[4,6-bis(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]phenol

0873-0068 Screening compound: 2-[(E)-{2-[4,6-bis(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]phenol
0873-0068 Screening compound: 2-[(E)-{2-[4,6-bis(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0873-0068
2-[(E)-{2-[4,6-bis(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]phenol

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

0873-0068

Molecular Formula

C22H31N7O (C22 H31 N7 O)

Compound Name

2-[(E)-{2-[4,6-bis(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]phenol

IUPAC name

2-[(E)-{2-[46-bis(azepan-1-yl)-135-triazin-2-yl]hydrazin-1-ylidene}methyl]phenol

SMILES

Oc1c(/C=N/Nc2nc(N3CCCCCC3)nc(N3CCCCCC3)n2)cccc1

InChI

InChI=1S/C22H31N7O/c30-19-12-6-5-11-18(19)17-23-27-20-24-21(28-13-7-1-2-8-14-28)26-22(25-20)29-15-9-3-4-10-16-29/h5-6,11-12,17,30H,1-4,7-10,13-16H2,(H,24,25,26,27)

InChI Key

ZKZIJDAUUJJJOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00993067

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.846

Distribution Coefficient, logD

6.819

Water Solubility, LogSw

-5.94

Polar Surface Area

74.345

Acid Dissociation Constant (pKa)

9.50

Base Dissociation Constant (pKb)

7.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with 0873-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0873-0068?
Check Price and Availability of 0873-0068, 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 0873-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0873-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0873-0068
  • 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 0873-0068 available by request