8007-7744 Screening compound: 5-bromo-4-[(E)-[2-(4-{[(furan-2-yl)methyl]amino}-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl)hydrazin-1-ylidene]methyl]-2-methoxyphenol

8007-7744 Screening compound: 5-bromo-4-[(E)-[2-(4-{[(furan-2-yl)methyl]amino}-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl)hydrazin-1-ylidene]methyl]-2-methoxyphenol
8007-7744 Screening compound: 5-bromo-4-[(E)-[2-(4-{[(furan-2-yl)methyl]amino}-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl)hydrazin-1-ylidene]methyl]-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-7744
5-bromo-4-[(E)-[2-(4-{[(furan-2-yl)methyl]amino}-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl)hydrazin-1-ylidene]methyl]-2-methoxyphenol

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

8007-7744

Molecular Formula

C23H22BrN7O4 (C23 H22 BrN7 O4)

Compound Name

5-bromo-4-[(E)-[2-(4-{[(furan-2-yl)methyl]amino}-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl)hydrazin-1-ylidene]methyl]-2-methoxyphenol

IUPAC name

5-bromo-4-[(E)-[2-(4-{[(furan-2-yl)methyl]amino}-6-[(4-methoxyphenyl)amino]-135-triazin-2-yl)hydrazin-1-ylidene]methyl]-2-methoxyphenol

SMILES

COc(cc1)ccc1Nc1nc(NCc2ccco2)nc(N/N=C/c(cc(c(O)c2)OC)c2Br)n1

InChI

InChI=1S/C23H22BrN7O4/c1-33-16-7-5-15(6-8-16)27-22-28-21(25-13-17-4-3-9-35-17)29-23(30-22)31-26-12-14-10-20(34-2)19(32)11-18(14)24/h3-12,32H,13H2,1-2H3,(H3,25,27,28,29,30,31)

InChI Key

DEGJHSAPGZRQGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01036096

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

540.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.872

Distribution Coefficient, logD

5.855

Water Solubility, LogSw

-5.39

Polar Surface Area

113.262

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

4.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

8007-7744 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8007-7744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-7744?
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What is the minimum amount of 8007-7744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-7744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-7744
  • 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 8007-7744 available by request