8015-3628 Screening compound: diethyl 2-[amino(2-{(E)-1-[4-(benzyloxy)phenyl]methylidene}hydrazino)methylene]malonate

8015-3628 Screening compound: diethyl 2-[amino(2-{(E)-1-[4-(benzyloxy)phenyl]methylidene}hydrazino)methylene]malonate
8015-3628 Screening compound: diethyl 2-[amino(2-{(E)-1-[4-(benzyloxy)phenyl]methylidene}hydrazino)methylene]malonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-3628
diethyl 2-[amino(2-{(E)-1-[4-(benzyloxy)phenyl]methylidene}hydrazino)methylene]malonate

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

8015-3628

Molecular Formula

C22H25N3O5 (C22 H25 N3 O5)

Compound Name

diethyl 2-[amino(2-{(E)-1-[4-(benzyloxy)phenyl]methylidene}hydrazino)methylene]malonate

IUPAC name

13-diethyl 2-{amino[(2E)-2-{[4-(benzyloxy)phenyl]methylidene}hydrazin-1-yl]methylidene}propanedioate

SMILES

CCOC(C(C(OCC)=O)=C(N)N/N=C/c(cc1)ccc1OCc1ccccc1)=O

InChI

InChI=1S/C22H25N3O5/c1-3-28-21(26)19(22(27)29-4-2)20(23)25-24-14-16-10-12-18(13-11-16)30-15-17-8-6-5-7-9-17/h5-14,25H,3-4,15,23H2,1-2H3

InChI Key

VENJYADGATYGDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.771

Distribution Coefficient, logD

2.360

Water Solubility, LogSw

-4.06

Polar Surface Area

93.127

Acid Dissociation Constant (pKa)

6.01

Base Dissociation Constant (pKb)

3.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.73

8015-3628 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 8015-3628 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-3628?
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What is the minimum amount of 8015-3628 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-3628
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-3628
  • 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 8015-3628 available by request