2130-0225 Screening compound: N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-nitrobenzohydrazide

2130-0225 Screening compound: N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-nitrobenzohydrazide
2130-0225 Screening compound: N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-nitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2130-0225
N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-nitrobenzohydrazide

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

2130-0225

Molecular Formula

C15H12BrN3O5 (C15 H12 BrN3 O5)

Compound Name

N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-nitrobenzohydrazide

IUPAC name

N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-nitrobenzohydrazide

SMILES

COc1cc(/C=N/NC(c2cc([N+]([O-])=O)ccc2)=O)cc(Br)c1O

InChI

InChI=1S/C15H12BrN3O5/c1-24-13-6-9(5-12(16)14(13)20)8-17-18-15(21)10-3-2-4-11(7-10)19(22)23/h2-8,20H,1H3,(H,18,21)

InChI Key

NOHKXFJEFFXJRB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00998098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.18

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.998

Distribution Coefficient, logD

2.663

Water Solubility, LogSw

-3.20

Polar Surface Area

92.045

Acid Dissociation Constant (pKa)

7.33

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

2130-0225 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 2130-0225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2130-0225?
Check Price and Availability of 2130-0225, 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 2130-0225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2130-0225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2130-0225
  • 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 2130-0225 available by request