8005-7987 Screening compound: N-({N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)-3-fluorobenzamide

8005-7987 Screening compound: N-({N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)-3-fluorobenzamide
8005-7987 Screening compound: N-({N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-7987
N-({N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)-3-fluorobenzamide

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

8005-7987

Molecular Formula

C18H17BrFN3O4 (C18 H17 BrFN3 O4)

Compound Name

N-({N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)-3-fluorobenzamide

IUPAC name

N-({N'-[(E)-(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]hydrazinecarbonyl}methyl)-3-fluorobenzamide

SMILES

CCOc1cc(/C=N/NC(CNC(c2cc(F)ccc2)=O)=O)cc(Br)c1O

InChI

InChI=1S/C18H17BrFN3O4/c1-2-27-15-7-11(6-14(19)17(15)25)9-22-23-16(24)10-21-18(26)12-4-3-5-13(20)8-12/h3-9,25H,2,10H2,1H3,(H,21,26)(H,23,24)

InChI Key

FPLHBTGBGQGGHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00822479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.25

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.341

Distribution Coefficient, logD

3.315

Water Solubility, LogSw

-3.42

Polar Surface Area

82.715

Acid Dissociation Constant (pKa)

8.61

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 8005-7987 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-7987?
Check Price and Availability of 8005-7987, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8005-7987 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-7987
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-7987
  • 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 8005-7987 available by request