4076-0038 Screening compound: 3-(1H-1,3-benzodiazol-1-yl)-N'-[(Z)-(4-ethoxyphenyl)methylidene]propanehydrazide

4076-0038 Screening compound: 3-(1H-1,3-benzodiazol-1-yl)-N'-[(Z)-(4-ethoxyphenyl)methylidene]propanehydrazide
4076-0038 Screening compound: 3-(1H-1,3-benzodiazol-1-yl)-N'-[(Z)-(4-ethoxyphenyl)methylidene]propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4076-0038
3-(1H-1,3-benzodiazol-1-yl)-N'-[(Z)-(4-ethoxyphenyl)methylidene]propanehydrazide

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

4076-0038

Molecular Formula

C19H20N4O2 (C19 H20 N4 O2)

Compound Name

3-(1H-1,3-benzodiazol-1-yl)-N'-[(Z)-(4-ethoxyphenyl)methylidene]propanehydrazide

IUPAC name

3-(1H-13-benzodiazol-1-yl)-N'-[(Z)-(4-ethoxyphenyl)methylidene]propanehydrazide

SMILES

CCOc1ccc(/C=N\NC(CCn2c(cccc3)c3nc2)=O)cc1

InChI

InChI=1S/C19H20N4O2/c1-2-25-16-9-7-15(8-10-16)13-21-22-19(24)11-12-23-14-20-17-5-3-4-6-18(17)23/h3-10,13-14H,2,11-12H2,1H3,(H,22,24)

InChI Key

QVBYTRZAZRGQMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016250

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.771

Distribution Coefficient, logD

2.769

Water Solubility, LogSw

-2.91

Polar Surface Area

52.899

Acid Dissociation Constant (pKa)

10.08

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

4076-0038 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 4076-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4076-0038?
Check Price and Availability of 4076-0038, 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 4076-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4076-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4076-0038
  • 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 4076-0038 available by request