8004-0713 Screening compound: N'-[(E)-[4-(benzyloxy)phenyl]methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide
Chemical Structure Depiction of ChemDiv screening compound 8004-0713
N'-[(E)-[4-(benzyloxy)phenyl]methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide
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
8004-0713
Molecular Formula
C30H36N2O3 (C30 H36 N2 O3)
Compound Name
N'-[(E)-[4-(benzyloxy)phenyl]methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide
IUPAC name
N'-[(E)-[4-(benzyloxy)phenyl]methylidene]-2-[4-(244-trimethylpentan-2-yl)phenoxy]acetohydrazide
SMILES
CC(C)(C)CC(C)(C)c(cc1)ccc1OCC(N/N=C/c(cc1)ccc1OCc1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
472.63
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
7.352
Distribution Coefficient, logD
7.352
Water Solubility, LogSw
-5.84
Polar Surface Area
50.067
Acid Dissociation Constant (pKa)
10.56
Base Dissociation Constant (pKb)
2.64
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
8004-0713 in Drug Discovery
Included in Screening Libraries
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with 8004-0713 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)