3938-1456 Screening compound: 5-{4-[(2,5-dimethylphenyl)amino]phthalazin-1-yl}-N,2-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound 3938-1456
5-{4-[(2,5-dimethylphenyl)amino]phthalazin-1-yl}-N,2-dimethylbenzene-1-sulfonamide
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
3938-1456
Molecular Formula
C24H24N4O2S (C24 H24 N4 O2 S)
Compound Name
5-{4-[(2,5-dimethylphenyl)amino]phthalazin-1-yl}-N,2-dimethylbenzene-1-sulfonamide
IUPAC name
5-{4-[(25-dimethylphenyl)amino]phthalazin-1-yl}-N2-dimethylbenzene-1-sulfonamide
SMILES
Cc1cc(Nc2nnc(-c3cc(S(NC)(=O)=O)c(C)cc3)c3ccccc23)c(C)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
432.55
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.758
Distribution Coefficient, logD
4.754
Water Solubility, LogSw
-4.71
Polar Surface Area
72.213
Acid Dissociation Constant (pKa)
10.38
Base Dissociation Constant (pKb)
5.32
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
16.70
3938-1456 in Drug Discovery
Included in Screening Libraries
Autophagy-Targeted Library (4564 compounds)
CNS targets activity set (6557 compounds)
Human Receptors Annotated Library (5376 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Agro
References: we are preparing a list of scientific research reports with 3938-1456 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)