3229-1148 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-ethoxyphenyl 4-methylbenzoate

3229-1148 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-ethoxyphenyl 4-methylbenzoate
3229-1148 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-ethoxyphenyl 4-methylbenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3229-1148
4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-ethoxyphenyl 4-methylbenzoate

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

3229-1148

Molecular Formula

C28H33N7O5 (C28 H33 N7 O5)

Compound Name

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

IUPAC name

4-[(E)-{2-[46-bis(morpholin-4-yl)-135-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-ethoxyphenyl 4-methylbenzoate

SMILES

CCOc(cc(/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1)cc1)c1OC(c1ccc(C)cc1)=O

InChI

InChI=1S/C28H33N7O5/c1-3-39-24-18-21(6-9-23(24)40-25(36)22-7-4-20(2)5-8-22)19-29-33-26-30-27(34-10-14-37-15-11-34)32-28(31-26)35-12-16-38-17-13-35/h4-9,18-19H,3,10-17H2,1-2H3,(H,30,31,32,33)

InChI Key

CGJIDBOIEOJJGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00609441

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

547.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.219

Distribution Coefficient, logD

5.126

Water Solubility, LogSw

-5.11

Polar Surface Area

100.627

Acid Dissociation Constant (pKa)

11.24

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with 3229-1148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3229-1148?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3229-1148
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  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3229-1148
  • 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 3229-1148 available by request