RefChem:1050547
TL;DR: RefChem:1050547 (CAS 67026-17-9) is a chemical compound with molecular formula C15H24N6O3 and molecular weight 336.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-propan-2-yl-1,3-dioxan-5-yl]methanol
Also Known As: 1,3-Dioxane-5-methanol, 5-((4,6-bis(1-aziridinyl)-1,3,5-triazin-2-yl)amino)-2-(1-methylethyl)-, 5-(4,6-Diaziridinyl-2-s-triazinylamino)-2-(2-propyl)-m-dioxane-5-methanol, s-Triazine, 4,6-diaziridinyl-2-(2-propyl-5-hydroxymethyl-m-dioxan-5-ylamino)-, m-DIOXANE-5-METHANOL, 2-(2-PROPYL)-5-(4,6-DIAZIRIDINYL-2-s-TRIAZINYLAMINO)-, [5-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-propan-2-yl-1,3-dioxan-5-yl]methanol
| Molecular Formula | C15H24N6O3 |
|---|---|
| Molecular Weight | 336.19 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 95.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.19098 |
| Heavy Atoms | 24 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 67026-17-9 |
|---|---|
| SMILES | CC(C)C1OCC(CO1)(CO)NC2=NC(=NC(=N2)N3CC3)N4CC4 |
| InChIKey | BVRMBCUZDYUFBT-UHFFFAOYSA-N |
Product Overview
RefChem:1050547 (CAS 67026-17-9), with molecular formula C15H24N6O3 and molecular weight 336.19 g/mol. IUPAC: [5-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-propan-2-yl-1,3-dioxan-5-yl]methanol.
Chemical Property Profile of RefChem:1050547
Property Insights of RefChem:1050547
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1050547. The TPSA of 95.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1050547. Following Lipinski's Rule of Five, RefChem:1050547 has 2 hydrogen bond donor(s) and 9 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 RefChem:1050547?
The CAS number of RefChem:1050547 is 67026-17-9.
What is the molecular formula of RefChem:1050547?
The molecular formula of RefChem:1050547 is C15H24N6O3.
What is the molecular weight of RefChem:1050547?
The molecular weight of RefChem:1050547 is 336.19 g/mol.
Where can I buy RefChem:1050547?
You can request a quote for RefChem:1050547 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1050547?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1050547 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.