1731-0892 Screening compound: 2-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine

1731-0892 Screening compound: 2-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine
1731-0892 Screening compound: 2-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1731-0892
2-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine

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

1731-0892

Molecular Formula

C15H19F6N5O2 (C15 H19 F6 N5 O2)

Compound Name

2-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine

IUPAC name

2-[(111333-hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-135-triazine

SMILES

FC(C(C(F)(F)F)Oc1nc(N2CCOCC2)nc(N2CCCCC2)n1)(F)F

InChI

InChI=1S/C15H19F6N5O2/c16-14(17,18)10(15(19,20)21)28-13-23-11(25-4-2-1-3-5-25)22-12(24-13)26-6-8-27-9-7-26/h10H,1-9H2

InChI Key

ZFDDLKLYIHKQBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00349963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.786

Distribution Coefficient, logD

4.786

Water Solubility, LogSw

-4.63

Polar Surface Area

49.348

Acid Dissociation Constant (pKa)

19.02

Base Dissociation Constant (pKb)

9.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

80.00

1731-0892 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1731-0892 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1731-0892?
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What is the minimum amount of 1731-0892 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1731-0892
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1731-0892
  • 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 1731-0892 available by request