N,N',N''-tris(propan-2-yl)guanidine
TL;DR: N,N',N''-tris(propan-2-yl)guanidine (CAS 121948-77-4) is a chemical compound with molecular formula C10H23N3 and molecular weight 185.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-tri(propan-2-yl)guanidine
Also Known As: 1,2,3-tri(propan-2-yl)guanidine, 1,2,3-Triisopropylguanidine, N,N',N''-Tris(1-methylethyl)guanidine, N,N',N''-tris(propan-2-yl)guanidine, N,N',N''-Triisopropylguanidine
| Molecular Formula | C10H23N3 |
|---|---|
| Molecular Weight | 185.19 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 185.1892 |
| Heavy Atoms | 13 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 121948-77-4 |
|---|---|
| SMILES | CC(C)NC(=NC(C)C)NC(C)C |
| InChIKey | ALOOBTJGUXDERE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N',N''-tris(propan-2-yl)guanidine (CAS 121948-77-4), with molecular formula C10H23N3 and molecular weight 185.19 g/mol. IUPAC: 1,2,3-tri(propan-2-yl)guanidine.
Chemical Property Profile of N,N',N''-tris(propan-2-yl)guanidine
Property Insights of N,N',N''-tris(propan-2-yl)guanidine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N',N''-tris(propan-2-yl)guanidine. With a topological polar surface area (TPSA) of 36.4 Ų, N,N',N''-tris(propan-2-yl)guanidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N',N''-tris(propan-2-yl)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',N''-tris(propan-2-yl)guanidine?
The CAS number of N,N',N''-tris(propan-2-yl)guanidine is 121948-77-4.
What is the molecular formula of N,N',N''-tris(propan-2-yl)guanidine?
The molecular formula of N,N',N''-tris(propan-2-yl)guanidine is C10H23N3.
What is the molecular weight of N,N',N''-tris(propan-2-yl)guanidine?
The molecular weight of N,N',N''-tris(propan-2-yl)guanidine is 185.19 g/mol.
Where can I buy N,N',N''-tris(propan-2-yl)guanidine?
You can request a quote for N,N',N''-tris(propan-2-yl)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',N''-tris(propan-2-yl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N,N',N''-tris(propan-2-yl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.