N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien
TL;DR: N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien (CAS 17173-00-1) is a chemical compound with molecular formula C20H16N2O2S2 and molecular weight 380.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide
Also Known As: N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien, N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide, Benzenesulfonamide, N-[6-(3-methyl-2(3H)-benzothiazolylidene)-2,4-cyclohexadien-1-ylidene]-
| Molecular Formula | C20H16N2O2S2 |
|---|---|
| Molecular Weight | 380.07 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.0653 |
| Heavy Atoms | 26 |
| Complexity | 768.0 |
Chemical Identifiers
| CAS Number | 17173-00-1 |
|---|---|
| SMILES | CN1C2=CC=CC=C2SC1=C3C=CC=CC3=NS(=O)(=O)C4=CC=CC=C4 |
| InChIKey | HNPMYMAKZZQGSE-UHFFFAOYSA-N |
Product Overview
N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien (CAS 17173-00-1), with molecular formula C20H16N2O2S2 and molecular weight 380.07 g/mol. IUPAC: N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide.
Chemical Property Profile of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien
Property Insights of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien
The XLogP value of 4.8 indicates that N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien 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 N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien. Following Lipinski's Rule of Five, N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien has 0 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 N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien?
The CAS number of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien is 17173-00-1.
What is the molecular formula of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien?
The molecular formula of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien is C20H16N2O2S2.
What is the molecular weight of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien?
The molecular weight of N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien is 380.07 g/mol.
Where can I buy N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien?
You can request a quote for N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien?
Yes, KEHONG BIO provides custom synthesis services for N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.