N-Dodecylguanidine acid phthalate
TL;DR: N-Dodecylguanidine acid phthalate (CAS 5835-86-9) is a chemical compound with molecular formula C21H35N3O4 and molecular weight 393.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dodecylguanidine;phthalic acid
Also Known As: N-DODECYLGUANIDINE ACID PHTHALATE, DODECYLGUANIDINE PHTHALATE, 2-dodecylguanidine; phthalic acid, 1,2-Benzenedicarboxylic acid, compd. with N-dodecylguanidine (1:1)
| Molecular Formula | C21H35N3O4 |
|---|---|
| Molecular Weight | 393.26 g/mol |
| LogP | 4.26 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 393.26276 |
| Heavy Atoms | 28 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 5835-86-9 |
|---|---|
| SMILES | CCCCCCCCCCCCN=C(N)N.C1=CC=C(C(=C1)C(=O)O)C(=O)O |
| InChIKey | GMEJIJCFEDISEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Dodecylguanidine acid phthalate (CAS 5835-86-9), with molecular formula C21H35N3O4 and molecular weight 393.26 g/mol. IUPAC: 2-dodecylguanidine;phthalic acid.
Chemical Property Profile of N-Dodecylguanidine acid phthalate
Property Insights of N-Dodecylguanidine acid phthalate
The XLogP value of 4.26 indicates that N-Dodecylguanidine acid phthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Dodecylguanidine acid phthalate. Following Lipinski's Rule of Five, N-Dodecylguanidine acid phthalate has 4 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 N-Dodecylguanidine acid phthalate?
The CAS number of N-Dodecylguanidine acid phthalate is 5835-86-9.
What is the molecular formula of N-Dodecylguanidine acid phthalate?
The molecular formula of N-Dodecylguanidine acid phthalate is C21H35N3O4.
What is the molecular weight of N-Dodecylguanidine acid phthalate?
The molecular weight of N-Dodecylguanidine acid phthalate is 393.26 g/mol.
Where can I buy N-Dodecylguanidine acid phthalate?
You can request a quote for N-Dodecylguanidine acid phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Dodecylguanidine acid phthalate?
Yes, KEHONG BIO provides custom synthesis services for N-Dodecylguanidine acid phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.