P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide
TL;DR: P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide (CAS 64486-53-9) is a chemical compound with molecular formula C15H15N3O2S2 and molecular weight 333.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzenesulfonamide
Also Known As: NCI60_025225, P-TOLUENESULFONIC (3-METHYL-2-BENZOTHIAZOLINYLIDENE)HYDRAZIDE, 4-methyl-N-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzenesulfonamide
| Molecular Formula | C15H15N3O2S2 |
|---|---|
| Molecular Weight | 333.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.06058 |
| Heavy Atoms | 22 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 64486-53-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NN=C2N(C3=CC=CC=C3S2)C |
| InChIKey | DBPQNNBERNJYOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide (CAS 64486-53-9), with molecular formula C15H15N3O2S2 and molecular weight 333.06 g/mol. IUPAC: 4-methyl-N-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzenesulfonamide.
Chemical Property Profile of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide
Property Insights of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide
The XLogP value of 3.4 indicates that P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide. Following Lipinski's Rule of Five, P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide?
The CAS number of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide is 64486-53-9.
What is the molecular formula of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide?
The molecular formula of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide is C15H15N3O2S2.
What is the molecular weight of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide?
The molecular weight of P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide is 333.06 g/mol.
Where can I buy P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide?
You can request a quote for P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for P-Toluenesulfonic (3-methyl-2-benzothiazolinylidene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.