N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine
TL;DR: N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine (CAS 51-13-8) is a chemical compound with molecular formula C10H14ClN3 and molecular weight 211.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-2,3-dimethylguanidine
Also Known As: Chlorobethanidine, Chlorobetanidine, BW 392C60, Guanidine, 1-(o-chlorobenzyl)-2,3-dimethyl-, NIOSH/ME9300000
| Molecular Formula | C10H14ClN3 |
|---|---|
| Molecular Weight | 211.09 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.08763 |
| Heavy Atoms | 14 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 51-13-8 |
|---|---|
| SMILES | CNC(=NC)NCC1=CC=CC=C1Cl |
| InChIKey | JCHVEDXZLFQDSL-UHFFFAOYSA-N |
Product Overview
N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine (CAS 51-13-8), with molecular formula C10H14ClN3 and molecular weight 211.09 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-2,3-dimethylguanidine.
Chemical Property Profile of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine
Property Insights of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine. With a topological polar surface area (TPSA) of 36.4 Ų, N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine 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-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine?
The CAS number of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine is 51-13-8.
What is the molecular formula of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine?
The molecular formula of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine is C10H14ClN3.
What is the molecular weight of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine?
The molecular weight of N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine is 211.09 g/mol.
Where can I buy N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine?
You can request a quote for N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine?
Yes, KEHONG BIO provides custom synthesis services for N-((2-Chlorophenyl)methyl)-N',N''-dimethylguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.