Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-
TL;DR: Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- (CAS 50823-97-7) is a chemical compound with molecular formula C12H11ClF2N4O and molecular weight 300.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[chloro(difluoro)methoxy]phenyl]methyl]pyrimidine-2,4-diamine
Also Known As: 5-[p- benzyl]-2,4-pyrimidinediamine, Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-, 5-25-13-00182 (Beilstein Handbook Reference), 5-(p-(Chlorodifluoromethoxy)benzyl)-2,4-diamino-pyrimidine, 5-[p-(Chlorodifluoromethoxy)benzyl]-2,4-pyrimidinediamine
| Molecular Formula | C12H11ClF2N4O |
|---|---|
| Molecular Weight | 300.06 g/mol |
| LogP | 2.3997 |
| Topological Polar Surface Area | 87.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.05896 |
| Heavy Atoms | 20 |
| Complexity | 601.3966 |
Chemical Identifiers
| CAS Number | 50823-97-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=CN=C(N=C2N)N)OC(F)(F)Cl |
Product Overview
Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- (CAS 50823-97-7), with molecular formula C12H11ClF2N4O and molecular weight 300.06 g/mol. IUPAC: 5-[[4-[chloro(difluoro)methoxy]phenyl]methyl]pyrimidine-2,4-diamine.
Chemical Property Profile of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-
Property Insights of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-
The XLogP value of 2.3997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-. The TPSA of 87.05 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-. Following Lipinski's Rule of Five, Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- has 2 hydrogen bond donor(s) and 5 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-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-?
The CAS number of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- is 50823-97-7.
What is the molecular formula of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-?
The molecular formula of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- is C12H11ClF2N4O.
What is the molecular weight of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-?
The molecular weight of Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- is 300.06 g/mol.
Where can I buy Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-?
You can request a quote for Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 5-(p-(chlorodifluoromethoxy)benzyl)-2,4-diamino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.