Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate
TL;DR: Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate (CAS 50824-02-7) is a chemical compound with molecular formula C14H19ClF2N4O7S2 and molecular weight 492.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-[chloro(difluoro)methoxy]phenyl]methyl]pyrimidine-2,4-diamine;methanesulfonic acid
Also Known As: Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate, 5-(m-(Chlorodifluoromethoxy)benzyl)-2,4-diamino-pyrimidine dimethanesulfonate, 2,4-Pyrimidinediamine, 5-((3-(chlorodifluoromethoxy)phenyl)methyl)-, dimethanesulfonate, 5-[[3-[chloro(difluoro)methoxy]phenyl]methyl]pyrimidine-2,4-diamine; methanesulfonic acid, Methanesulfonic acid--5-({3-[chlorodi(fluoro)methoxy]phenyl}methyl)pyrimidine-2,4-diamine (2/1)
| Molecular Formula | C14H19ClF2N4O7S2 |
|---|---|
| Molecular Weight | 492.04 g/mol |
| LogP | 1.4077 |
| Topological Polar Surface Area | 195.79 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 492.0352 |
| Heavy Atoms | 30 |
| Complexity | 1002.4964 |
Chemical Identifiers
| CAS Number | 50824-02-7 |
|---|---|
| SMILES | CS(=O)(=O)O.CS(=O)(=O)O.C1=CC(=CC(=C1)OC(F)(F)Cl)CC2=CN=C(N=C2N)N |
Product Overview
Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate (CAS 50824-02-7), with molecular formula C14H19ClF2N4O7S2 and molecular weight 492.04 g/mol. IUPAC: 5-[[3-[chloro(difluoro)methoxy]phenyl]methyl]pyrimidine-2,4-diamine;methanesulfonic acid.
Chemical Property Profile of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate
Property Insights of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate
The XLogP value of 1.4077 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate. The TPSA of 195.79 Ų indicates high polarity, suggesting Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate has 4 hydrogen bond donor(s) and 9 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 Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate?
The CAS number of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate is 50824-02-7.
What is the molecular formula of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate?
The molecular formula of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate is C14H19ClF2N4O7S2.
What is the molecular weight of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate?
The molecular weight of Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate is 492.04 g/mol.
Where can I buy Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate?
You can request a quote for Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, dimethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.