5922-0023 Screening compound: ethyl 4-{[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]oxy}benzoate

5922-0023 Screening compound: ethyl 4-{[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]oxy}benzoate
5922-0023 Screening compound: ethyl 4-{[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]oxy}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5922-0023
ethyl 4-{[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]oxy}benzoate

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

5922-0023

Molecular Formula

C16H21N5O3 (C16 H21 N5 O3)

Compound Name

ethyl 4-{[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]oxy}benzoate

IUPAC name

ethyl 4-{[4-(dimethylamino)-6-(ethylamino)-135-triazin-2-yl]oxy}benzoate

SMILES

CCNc1nc(Oc(cc2)ccc2C(OCC)=O)nc(N(C)C)n1

InChI

InChI=1S/C16H21N5O3/c1-5-17-14-18-15(21(3)4)20-16(19-14)24-12-9-7-11(8-10-12)13(22)23-6-2/h7-10H,5-6H2,1-4H3,(H,17,18,19,20)

InChI Key

OYKQGWGBRGJKAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05624991

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.095

Distribution Coefficient, logD

4.095

Water Solubility, LogSw

-4.11

Polar Surface Area

70.405

Acid Dissociation Constant (pKa)

17.14

Base Dissociation Constant (pKb)

3.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with 5922-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5922-0023?
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What is the minimum amount of 5922-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5922-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5922-0023
  • 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 5922-0023 available by request