C614-7045 Screening compound: 4-hydroxy-3-methoxy-N'-(3-nitrobenzoyl)benzohydrazide

C614-7045 Screening compound: 4-hydroxy-3-methoxy-N'-(3-nitrobenzoyl)benzohydrazide
C614-7045 Screening compound: 4-hydroxy-3-methoxy-N'-(3-nitrobenzoyl)benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-7045
4-hydroxy-3-methoxy-N'-(3-nitrobenzoyl)benzohydrazide

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

C614-7045

Molecular Formula

C15H13N3O6 (C15 H13 N3 O6)

Compound Name

4-hydroxy-3-methoxy-N'-(3-nitrobenzoyl)benzohydrazide

IUPAC name

4-hydroxy-3-methoxy-N'-(3-nitrobenzoyl)benzohydrazide

SMILES

COc(cc(cc1)C(NNC(c2cccc([N+]([O-])=O)c2)=O)=O)c1O

InChI

InChI=1S/C15H13N3O6/c1-24-13-8-10(5-6-12(13)19)15(21)17-16-14(20)9-3-2-4-11(7-9)18(22)23/h2-8,19H,1H3,(H,16,20)(H,17,21)

InChI Key

OVFHPMQODZMPSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14777071

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.365

Distribution Coefficient, logD

1.312

Water Solubility, LogSw

-2.09

Polar Surface Area

108.995

Acid Dissociation Constant (pKa)

8.28

Base Dissociation Constant (pKb)

-1.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

C614-7045 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 C614-7045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-7045?
Check Price and Availability of C614-7045, 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 C614-7045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-7045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-7045
  • 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 C614-7045 available by request