8009-3084 Screening compound: 1,3,5-tris(4-ethoxyphenyl)-1,3,5-triazinane

8009-3084 Screening compound: 1,3,5-tris(4-ethoxyphenyl)-1,3,5-triazinane
8009-3084 Screening compound: 1,3,5-tris(4-ethoxyphenyl)-1,3,5-triazinane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-3084
1,3,5-tris(4-ethoxyphenyl)-1,3,5-triazinane

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

8009-3084

Molecular Formula

C27H33N3O3 (C27 H33 N3 O3)

Compound Name

1,3,5-tris(4-ethoxyphenyl)-1,3,5-triazinane

IUPAC name

135-tris(4-ethoxyphenyl)-135-triazinane

SMILES

CCOc(cc1)ccc1N(CN(C1)c(cc2)ccc2OCC)CN1c(cc1)ccc1OCC

InChI

InChI=1S/C27H33N3O3/c1-4-31-25-13-7-22(8-14-25)28-19-29(23-9-15-26(16-10-23)32-5-2)21-30(20-28)24-11-17-27(18-12-24)33-6-3/h7-18H,4-6,19-21H2,1-3H3

InChI Key

IPJSUMKHBGDQMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00763762

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.58

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.283

Distribution Coefficient, logD

7.283

Water Solubility, LogSw

-5.94

Polar Surface Area

33.802

Acid Dissociation Constant (pKa)

28.70

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8009-3084 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8009-3084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-3084?
Check Price and Availability of 8009-3084, 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 8009-3084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-3084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-3084
  • 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 8009-3084 available by request