6434-3642 Screening compound: 2-(4-methylphenoxy)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of ChemDiv screening compound 6434-3642
2-(4-methylphenoxy)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethan-1-one
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
6434-3642
Molecular Formula
C27H26N4O2 (C27 H26 N4 O2)
Compound Name
2-(4-methylphenoxy)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethan-1-one
IUPAC name
2-(4-methylphenoxy)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethan-1-one
SMILES
Cc(cc1)ccc1OCC(N(CC1)CCN1c1nnc(-c2ccccc2)c2ccccc12)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
438.53
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.377
Distribution Coefficient, logD
4.377
Water Solubility, LogSw
-4.21
Polar Surface Area
49.022
Acid Dissociation Constant (pKa)
24.12
Base Dissociation Constant (pKb)
5.19
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
6434-3642 in Drug Discovery
Included in Screening Libraries
CNS targets activity set (6557 compounds)
Human Ion Channels Annotated Library (353 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Protein-Protein Interaction Library (218420 compounds)
Voltage-Gated Ion Channel-Targeted Library (4740 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Nervous system
- Immune system
- Kinases
- Ion Channels
- PPI modulators
- Receptor's ligands
References: we are preparing a list of scientific research reports with 6434-3642 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)