3229-0845 Screening compound: 4-[(2E)-2-[(4-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-3-methoxyphenyl)methylidene]hydrazin-1-yl]-N-phenyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine

3229-0845 Screening compound: 4-[(2E)-2-[(4-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-3-methoxyphenyl)methylidene]hydrazin-1-yl]-N-phenyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
3229-0845 Screening compound: 4-[(2E)-2-[(4-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-3-methoxyphenyl)methylidene]hydrazin-1-yl]-N-phenyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3229-0845
4-[(2E)-2-[(4-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-3-methoxyphenyl)methylidene]hydrazin-1-yl]-N-phenyl-6-(piperidin-1-yl)-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

3229-0845

Molecular Formula

C33H40N12O4 (C33 H40 N12 O4)

Compound Name

4-[(2E)-2-[(4-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-3-methoxyphenyl)methylidene]hydrazin-1-yl]-N-phenyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine

IUPAC name

4-[(2E)-2-[(4-{[46-bis(morpholin-4-yl)-135-triazin-2-yl]oxy}-3-methoxyphenyl)methylidene]hydrazin-1-yl]-N-phenyl-6-(piperidin-1-yl)-135-triazin-2-amine

SMILES

COc(cc(/C=N/Nc1nc(N2CCCCC2)nc(Nc2ccccc2)n1)cc1)c1Oc1nc(N2CCOCC2)nc(N2CCOCC2)n1

InChI

InChI=1S/C33H40N12O4/c1-46-27-22-24(23-34-42-29-36-28(35-25-8-4-2-5-9-25)37-30(38-29)43-12-6-3-7-13-43)10-11-26(27)49-33-40-31(44-14-18-47-19-15-44)39-32(41-33)45-16-20-48-21-17-45/h2,4-5,8-11,22-23H,3,6-7,12-21H2,1H3,(H2,35,36,37,38,42)

InChI Key

RNXUUVXEAVOITR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01590280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

668.76

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

16

Partition Coefficient, logP

7.031

Distribution Coefficient, logD

7.030

Water Solubility, LogSw

-5.82

Polar Surface Area

129.510

Acid Dissociation Constant (pKa)

12.81

Base Dissociation Constant (pKb)

4.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.40

References: we are preparing a list of scientific research reports with 3229-0845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3229-0845?
Check Price and Availability of 3229-0845, 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 3229-0845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3229-0845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3229-0845
  • 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 3229-0845 available by request