1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine
TL;DR: 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine (CAS 6333-47-7) is a chemical compound with molecular formula C20H32BrN5 and molecular weight 421.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromophenyl)-2-undecyl-2H-1,3,5-triazine-4,6-diamine
Also Known As: 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine, 1-(3-bromophenyl)-2-undecyl-2H-1,3,5-triazine-4,6-diamine, 1-(3-bromophenyl)-6-undecyl-6H-1,3,5-triazine-2,4-diamine, 1-(3-Bromophenyl)-1,6-dihydro-6-undecyl-1,3,5-triazine-2,4-diamine, 1-(3-Bromophenyl)-6-undecyl-1,6-dihydro-1,3,5-triazine-2,4-diamine
| Molecular Formula | C20H32BrN5 |
|---|---|
| Molecular Weight | 421.18 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Exact Mass | 421.1841 |
| Heavy Atoms | 26 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 6333-47-7 |
|---|---|
| SMILES | CCCCCCCCCCCC1N=C(N=C(N1C2=CC(=CC=C2)Br)N)N |
| InChIKey | FPOQVODWSVXDGO-UHFFFAOYSA-N |
Product Overview
1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine (CAS 6333-47-7), with molecular formula C20H32BrN5 and molecular weight 421.18 g/mol. IUPAC: 1-(3-bromophenyl)-2-undecyl-2H-1,3,5-triazine-4,6-diamine.
Chemical Property Profile of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine
Property Insights of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine
The XLogP value of 6.1 indicates that 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine. Following Lipinski's Rule of Five, 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine?
The CAS number of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine is 6333-47-7.
What is the molecular formula of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine?
The molecular formula of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine is C20H32BrN5.
What is the molecular weight of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine?
The molecular weight of 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine is 421.18 g/mol.
Where can I buy 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine?
You can request a quote for 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Bromophenyl)-6-undecyl-1,3,5-triazinane-2,4-diimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.