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2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine
TL;DR: 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine (CAS 98950-45-9) is a chemical compound with molecular formula C9H12ClN5O and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine
Also Known As: 4-Chlorobenzyloxybiguanide, BIGUANIDE, 1-(p-CHLOROBENZYLOXY)-, Imidodicarbonimidicdiamide, N-[(4-chlorophenyl)methoxy]-
| Molecular Formula | C9H12ClN5O |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.07304 |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 98950-45-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CON=C(N)N=C(N)N)Cl |
| InChIKey | CSHFMVWINHMKQU-UHFFFAOYSA-N |
Product Overview
2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine (CAS 98950-45-9), with molecular formula C9H12ClN5O and molecular weight 241.07 g/mol. IUPAC: 2-[(4-chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine.
Chemical Property Profile of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine
Property Insights of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine. Following Lipinski's Rule of Five, 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine has 3 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 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine?
The CAS number of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine is 98950-45-9.
What is the molecular formula of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine?
The molecular formula of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine is C9H12ClN5O.
What is the molecular weight of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine?
The molecular weight of 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine is 241.07 g/mol.
Where can I buy 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine?
You can request a quote for 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Chlorophenyl)methoxy]-1-(diaminomethylidene)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.