N,N'-Bis(dimethylphenyl)guanidine
TL;DR: N,N'-Bis(dimethylphenyl)guanidine (CAS 90-70-0) is a chemical compound with molecular formula C17H21N3 and molecular weight 267.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis(2,3-dimethylphenyl)guanidine
Also Known As: N,N'-Dixylylguanidine, N,N'-Bis(dimethylphenyl)guanidine, Guanidine, N,N'-bis(dimethylphenyl)-, Guanidine, 1,3-di-2,3-xylyl-, 1,2-bis(2,3-dimethylphenyl)guanidine
| Molecular Formula | C17H21N3 |
|---|---|
| Molecular Weight | 267.17 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.17355 |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 90-70-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=NC2=CC=CC(=C2C)C)N)C |
| InChIKey | SQDYIZWEQGMDFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-Bis(dimethylphenyl)guanidine (CAS 90-70-0), with molecular formula C17H21N3 and molecular weight 267.17 g/mol. IUPAC: 1,2-bis(2,3-dimethylphenyl)guanidine.
Chemical Property Profile of N,N'-Bis(dimethylphenyl)guanidine
Property Insights of N,N'-Bis(dimethylphenyl)guanidine
The XLogP value of 3.8 indicates that N,N'-Bis(dimethylphenyl)guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, N,N'-Bis(dimethylphenyl)guanidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-Bis(dimethylphenyl)guanidine has 2 hydrogen bond donor(s) and 1 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,N'-Bis(dimethylphenyl)guanidine?
The CAS number of N,N'-Bis(dimethylphenyl)guanidine is 90-70-0.
What is the molecular formula of N,N'-Bis(dimethylphenyl)guanidine?
The molecular formula of N,N'-Bis(dimethylphenyl)guanidine is C17H21N3.
What is the molecular weight of N,N'-Bis(dimethylphenyl)guanidine?
The molecular weight of N,N'-Bis(dimethylphenyl)guanidine is 267.17 g/mol.
Where can I buy N,N'-Bis(dimethylphenyl)guanidine?
You can request a quote for N,N'-Bis(dimethylphenyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Bis(dimethylphenyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Bis(dimethylphenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.