4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa
TL;DR: 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa (CAS 17173-01-2) is a chemical compound with molecular formula C21H18N2O2S2 and molecular weight 394.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide
Also Known As: 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa, 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide, Benzenesulfonamide,4-methyl-N-[6-(3-methyl-2(3H)-benzothiazolylidene)-2,4-cyclohexadien-1-ylidene]-
| Molecular Formula | C21H18N2O2S2 |
|---|---|
| Molecular Weight | 394.08 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 394.08096 |
| Heavy Atoms | 27 |
| Complexity | 797.0 |
Chemical Identifiers
| CAS Number | 17173-01-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N=C2C=CC=CC2=C3N(C4=CC=CC=C4S3)C |
| InChIKey | JGKDHNQVHVOFMG-UHFFFAOYSA-N |
Product Overview
4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa (CAS 17173-01-2), with molecular formula C21H18N2O2S2 and molecular weight 394.08 g/mol. IUPAC: 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide.
Chemical Property Profile of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa
Property Insights of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa
The XLogP value of 5.1 indicates that 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa. Following Lipinski's Rule of Five, 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa?
The CAS number of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa is 17173-01-2.
What is the molecular formula of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa?
The molecular formula of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa is C21H18N2O2S2.
What is the molecular weight of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa?
The molecular weight of 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa is 394.08 g/mol.
Where can I buy 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa?
You can request a quote for 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.