2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol
TL;DR: 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol (CAS 309286-76-8) is a chemical compound with molecular formula C17H16Br2OS2 and molecular weight 457.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol
Also Known As: ChemDiv1_021348, BAS 01181123, AB01315002-02, A2136/0089696, 2,4-dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol
| Molecular Formula | C17H16Br2OS2 |
|---|---|
| Molecular Weight | 457.90 g/mol |
| LogP | 6.71284 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 457.90094 |
| Heavy Atoms | 22 |
| Complexity | 698.0842 |
Chemical Identifiers
| CAS Number | 309286-76-8 |
|---|---|
| SMILES | CC1=CC2=C(CSC(SC2)C3=C(C(=CC(=C3)Br)Br)O)C=C1C |
Product Overview
2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol (CAS 309286-76-8), with molecular formula C17H16Br2OS2 and molecular weight 457.90 g/mol. IUPAC: 2,4-dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol.
Chemical Property Profile of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol
Property Insights of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol
The XLogP value of 6.71284 indicates that 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol?
The CAS number of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol is 309286-76-8.
What is the molecular formula of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol?
The molecular formula of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol is C17H16Br2OS2.
What is the molecular weight of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol?
The molecular weight of 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol is 457.90 g/mol.
Where can I buy 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol?
You can request a quote for 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dibromo-6-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.