8008-9809 Screening compound: 5-(diethylamino)-2-[(E)-(2-{6-[(4-fluorophenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazin-1-ylidene)methyl]phenol

8008-9809 Screening compound: 5-(diethylamino)-2-[(E)-(2-{6-[(4-fluorophenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazin-1-ylidene)methyl]phenol
8008-9809 Screening compound: 5-(diethylamino)-2-[(E)-(2-{6-[(4-fluorophenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazin-1-ylidene)methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-9809
5-(diethylamino)-2-[(E)-(2-{6-[(4-fluorophenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazin-1-ylidene)methyl]phenol

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

8008-9809

Molecular Formula

C21H21FN8O2 (C21 H21 FN8 O2)

Compound Name

5-(diethylamino)-2-[(E)-(2-{6-[(4-fluorophenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazin-1-ylidene)methyl]phenol

IUPAC name

5-(diethylamino)-2-[(E)-(2-{6-[(4-fluorophenyl)amino]-[125]oxadiazolo[34-b]pyrazin-5-yl}hydrazin-1-ylidene)methyl]phenol

SMILES

CCN(CC)c1cc(O)c(/C=N/Nc2nc3nonc3nc2Nc(cc2)ccc2F)cc1

InChI

InChI=1S/C21H21FN8O2/c1-3-30(4-2)16-10-5-13(17(31)11-16)12-23-27-19-18(24-15-8-6-14(22)7-9-15)25-20-21(26-19)29-32-28-20/h5-12,31H,3-4H2,1-2H3,(H,24,25,28)(H,26,27,29)

InChI Key

YEQJIOJCOGIMBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460639

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.341

Distribution Coefficient, logD

5.340

Water Solubility, LogSw

-5.20

Polar Surface Area

106.055

Acid Dissociation Constant (pKa)

10.64

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with 8008-9809 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-9809?
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What is the minimum amount of 8008-9809 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-9809
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-9809
  • 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 8008-9809 available by request