![2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol structure](/static/products/6960/6960-14-1.webp)
2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol
TL;DR: 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol (CAS 6960-14-1) is a chemical compound with molecular formula C24H22Cl4N2O and molecular weight 494.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1,3-bis[(3,4-dichlorophenyl)methyl]-1,3-diazinan-2-yl]phenol
Also Known As: 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol, 2-[1,3-bis[(3,4-dichlorophenyl)methyl]-1,3-diazinan-2-yl]phe, 2-[1,3-bis[(3,4-dichlorophenyl)methyl]-1,3-diazinan-2-yl]phenol, 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]-1,3-diazinan-2-yl}phenol
| Molecular Formula | C24H22Cl4N2O |
|---|---|
| Molecular Weight | 494.05 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 26.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 494.0486 |
| Heavy Atoms | 31 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 6960-14-1 |
|---|---|
| SMILES | C1CN(C(N(C1)CC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3O)CC4=CC(=C(C=C4)Cl)Cl |
| InChIKey | SLTPGZJGQABAIE-UHFFFAOYSA-N |
Product Overview
2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol (CAS 6960-14-1), with molecular formula C24H22Cl4N2O and molecular weight 494.05 g/mol. IUPAC: 2-[1,3-bis[(3,4-dichlorophenyl)methyl]-1,3-diazinan-2-yl]phenol.
Chemical Property Profile of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol
Property Insights of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol
The XLogP value of 7.2 indicates that 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.7 Ų, 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-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-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol?
The CAS number of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol is 6960-14-1.
What is the molecular formula of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol?
The molecular formula of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol is C24H22Cl4N2O.
What is the molecular weight of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol?
The molecular weight of 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol is 494.05 g/mol.
Where can I buy 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol?
You can request a quote for 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-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-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-{1,3-Bis[(3,4-dichlorophenyl)methyl]hexahydropyrimidin-2-yl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.