![2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol structure](/static/products/7638/76383-16-9.webp)
2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol
TL;DR: 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol (CAS 76383-16-9) is a chemical compound with molecular formula C20H22N2OS2 and molecular weight 370.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol
Also Known As: 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol, (6E)-6-[[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl, 6-[[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)amino]methylidene]cyclohexa-2,4-dien-1-one, (6E)-6-({[2-(Hexylsulfanyl)-1,3-benzothiazol-6-yl]amino}methylidene)cyclohexa-2,4-dien-1-one, (6Z)-6-[[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)amino]methylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C20H22N2OS2 |
|---|---|
| Molecular Weight | 370.12 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 370.11737 |
| Heavy Atoms | 25 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 76383-16-9 |
|---|---|
| SMILES | CCCCCCSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=CC=C3O |
| InChIKey | AIFIUKHBQFRURN-UHFFFAOYSA-N |
Product Overview
2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol (CAS 76383-16-9), with molecular formula C20H22N2OS2 and molecular weight 370.12 g/mol. IUPAC: 2-[(2-hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol.
Chemical Property Profile of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol
Property Insights of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol
The XLogP value of 6.5 indicates that 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol. Following Lipinski's Rule of Five, 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol has 1 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 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol?
The CAS number of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol is 76383-16-9.
What is the molecular formula of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol?
The molecular formula of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol is C20H22N2OS2.
What is the molecular weight of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol?
The molecular weight of 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol is 370.12 g/mol.
Where can I buy 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol?
You can request a quote for 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Hexylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.