Tris(N-hydroxypropyl) hexahydrotriazine
TL;DR: Tris(N-hydroxypropyl) hexahydrotriazine (CAS 25254-50-6) is a chemical compound with molecular formula C12H27N3O3 and molecular weight 261.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(2-hydroxypropyl)-1,3,5-triazinan-1-yl]propan-2-ol
Also Known As: Caswell No. 481D, GROTAN WS, Tris(N-hydroxypropyl) hexahydrotriazine, Hexahydro-1,3,5-tris(2-hydroxypropyl)-s-triazine, EPA Pesticide Chemical Code 105601
| Molecular Formula | C12H27N3O3 |
|---|---|
| Molecular Weight | 261.21 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 70.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 261.20523 |
| Heavy Atoms | 18 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 25254-50-6 |
|---|---|
| SMILES | CC(CN1CN(CN(C1)CC(C)O)CC(C)O)O |
| InChIKey | QUGSRMKLRLHUHU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tris(N-hydroxypropyl) hexahydrotriazine (CAS 25254-50-6), with molecular formula C12H27N3O3 and molecular weight 261.21 g/mol. IUPAC: 1-[3,5-bis(2-hydroxypropyl)-1,3,5-triazinan-1-yl]propan-2-ol.
Chemical Property Profile of Tris(N-hydroxypropyl) hexahydrotriazine
Property Insights of Tris(N-hydroxypropyl) hexahydrotriazine
The XLogP value of -0.3 indicates that Tris(N-hydroxypropyl) hexahydrotriazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris(N-hydroxypropyl) hexahydrotriazine. Following Lipinski's Rule of Five, Tris(N-hydroxypropyl) hexahydrotriazine has 3 hydrogen bond donor(s) and 6 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 Tris(N-hydroxypropyl) hexahydrotriazine?
The CAS number of Tris(N-hydroxypropyl) hexahydrotriazine is 25254-50-6.
What is the molecular formula of Tris(N-hydroxypropyl) hexahydrotriazine?
The molecular formula of Tris(N-hydroxypropyl) hexahydrotriazine is C12H27N3O3.
What is the molecular weight of Tris(N-hydroxypropyl) hexahydrotriazine?
The molecular weight of Tris(N-hydroxypropyl) hexahydrotriazine is 261.21 g/mol.
Where can I buy Tris(N-hydroxypropyl) hexahydrotriazine?
You can request a quote for Tris(N-hydroxypropyl) hexahydrotriazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(N-hydroxypropyl) hexahydrotriazine?
Yes, KEHONG BIO provides custom synthesis services for Tris(N-hydroxypropyl) hexahydrotriazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.