8004-4717 Screening compound: 1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-N-[4-(pentyloxy)phenyl]formamide

8004-4717 Screening compound: 1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-N-[4-(pentyloxy)phenyl]formamide
8004-4717 Screening compound: 1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-N-[4-(pentyloxy)phenyl]formamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-4717
1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-N-[4-(pentyloxy)phenyl]formamide

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

8004-4717

Molecular Formula

C27H29N3O4 (C27 H29 N3 O4)

Compound Name

1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-N-[4-(pentyloxy)phenyl]formamide

IUPAC name

1-{N'-[(E)-[4-(benzyloxy)phenyl]methylidene]hydrazinecarbonyl}-N-[4-(pentyloxy)phenyl]formamide

SMILES

CCCCCOc(cc1)ccc1NC(C(N/N=C/c(cc1)ccc1OCc1ccccc1)=O)=O

InChI

InChI=1S/C27H29N3O4/c1-2-3-7-18-33-24-16-12-23(13-17-24)29-26(31)27(32)30-28-19-21-10-14-25(15-11-21)34-20-22-8-5-4-6-9-22/h4-6,8-17,19H,2-3,7,18,20H2,1H3,(H,29,31)(H,30,32)

InChI Key

SUPQFMFXHOKXAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00739195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.831

Distribution Coefficient, logD

5.158

Water Solubility, LogSw

-5.41

Polar Surface Area

73.562

Acid Dissociation Constant (pKa)

6.83

Base Dissociation Constant (pKb)

4.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8004-4717 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8004-4717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-4717?
Check Price and Availability of 8004-4717, 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 8004-4717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-4717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-4717
  • 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 8004-4717 available by request