N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine
TL;DR: N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine (CAS 90595-36-1) is a chemical compound with molecular formula C12H19N3O and molecular weight 221.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methoxyphenyl)-1,1,3,3-tetramethylguanidine
Also Known As: 2-(3'-methoxyphenyl)-1,1,3,3-tetramethylguanidine, N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl -guanidine, 2-(3-methoxyphenyl)-1,1,3,3-tetramethylguanidine
| Molecular Formula | C12H19N3O |
|---|---|
| Molecular Weight | 221.15 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 28.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.15282 |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 90595-36-1 |
|---|---|
| SMILES | CN(C)C(=NC1=CC(=CC=C1)OC)N(C)C |
| InChIKey | NWMZOZPDDQBVMK-UHFFFAOYSA-N |
Product Overview
N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine (CAS 90595-36-1), with molecular formula C12H19N3O and molecular weight 221.15 g/mol. IUPAC: 2-(3-methoxyphenyl)-1,1,3,3-tetramethylguanidine.
Chemical Property Profile of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine
Property Insights of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine. With a topological polar surface area (TPSA) of 28.1 Ų, N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine has 0 hydrogen bond donor(s) and 2 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 N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine?
The CAS number of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine is 90595-36-1.
What is the molecular formula of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine?
The molecular formula of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine is C12H19N3O.
What is the molecular weight of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine?
The molecular weight of N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine is 221.15 g/mol.
Where can I buy N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine?
You can request a quote for N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine?
Yes, KEHONG BIO provides custom synthesis services for N''-(3-methoxy-phenyl)-N,N,N',N'-tetramethyl-guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.