![2-[1,3-diazinan-2-yl]-4,6-dichlorophenol structure](/static/products/1795/17958-62-2.webp)
2-[1,3-diazinan-2-yl]-4,6-dichlorophenol
TL;DR: 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol (CAS 17958-62-2) is a chemical compound with molecular formula C32H38Cl6N4O and molecular weight 704.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1,3-bis[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-1,3-diazinan-2-yl]-4,6-dichlorophenol
Also Known As: 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol, 2-[1,3-bis[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-1,3-diazinan-2-yl]-4,6-dichlorophenol, 2-[1,3-Bis({4-[bis(2-chloroethyl)amino]phenyl}methyl)-1,3-diazinan-2-yl]-4,6-dichlorophenol
| Molecular Formula | C32H38Cl6N4O |
|---|---|
| Molecular Weight | 704.12 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 704.1177 |
| Heavy Atoms | 43 |
| Complexity | 714.0 |
Chemical Identifiers
| CAS Number | 17958-62-2 |
|---|---|
| SMILES | C1CN(C(N(C1)CC2=CC=C(C=C2)N(CCCl)CCCl)C3=C(C(=CC(=C3)Cl)Cl)O)CC4=CC=C(C=C4)N(CCCl)CCCl |
| InChIKey | NIOAHKAGMYPEHE-UHFFFAOYSA-N |
Product Overview
2-[1,3-diazinan-2-yl]-4,6-dichlorophenol (CAS 17958-62-2), with molecular formula C32H38Cl6N4O and molecular weight 704.12 g/mol. IUPAC: 2-[1,3-bis[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-1,3-diazinan-2-yl]-4,6-dichlorophenol.
Chemical Property Profile of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol
Property Insights of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol
The XLogP value of 8.6 indicates that 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.2 Ų, 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol 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-[1,3-diazinan-2-yl]-4,6-dichlorophenol?
The CAS number of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol is 17958-62-2.
What is the molecular formula of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol?
The molecular formula of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol is C32H38Cl6N4O.
What is the molecular weight of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol?
The molecular weight of 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol is 704.12 g/mol.
Where can I buy 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol?
You can request a quote for 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[1,3-diazinan-2-yl]-4,6-dichlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.