0806-0347 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-methoxyphenyl 4-fluorobenzoate

0806-0347 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-methoxyphenyl 4-fluorobenzoate
0806-0347 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-methoxyphenyl 4-fluorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0806-0347
4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-2-methoxyphenyl 4-fluorobenzoate

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

0806-0347

Molecular Formula

C26H28FN7O5 (C26 H28 FN7 O5)

Compound Name

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

IUPAC name

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

SMILES

COc(cc(/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1)cc1)c1OC(c(cc1)ccc1F)=O

InChI

InChI=1S/C26H28FN7O5/c1-36-22-16-18(2-7-21(22)39-23(35)19-3-5-20(27)6-4-19)17-28-32-24-29-25(33-8-12-37-13-9-33)31-26(30-24)34-10-14-38-15-11-34/h2-7,16-17H,8-15H2,1H3,(H,29,30,31,32)

InChI Key

FZWXRWMMMALSJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00641823

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.679

Distribution Coefficient, logD

4.586

Water Solubility, LogSw

-4.56

Polar Surface Area

101.047

Acid Dissociation Constant (pKa)

11.24

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with 0806-0347 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0806-0347?
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What is the minimum amount of 0806-0347 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0806-0347
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0806-0347
  • 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 0806-0347 available by request