1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)
TL;DR: 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) (CAS 18915-16-7) is a chemical compound with molecular formula C22H30Cl2N10S and molecular weight 536.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]sulfanylphenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine;dihydrochloride
Also Known As: 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2), 1,1'-(Thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-1,3,5-triazine-2,4-diamine) 2HCl 2H2O, 1,1'-[Sulfanediyldi(4,1-phenylene)]bis(6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine)--hydrogen chloride (1/2), 1-[4-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]sulfanylphenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine dihydrochloride, RefChem:217351
| Molecular Formula | C22H30Cl2N10S |
|---|---|
| Molecular Weight | 536.18 g/mol |
| LogP | 3.0524 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 536.1753 |
| Heavy Atoms | 35 |
| Complexity | 790.0 |
Chemical Identifiers
| CAS Number | 18915-16-7 |
|---|---|
| SMILES | CC1(N=C(N=C(N1C2=CC=C(C=C2)SC3=CC=C(C=C3)N4C(=NC(=NC4(C)C)N)N)N)N)C.Cl.Cl |
| InChIKey | QSXYTXQXILFMGJ-UHFFFAOYSA-N |
Product Overview
1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) (CAS 18915-16-7), with molecular formula C22H30Cl2N10S and molecular weight 536.18 g/mol. IUPAC: 1-[4-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]sulfanylphenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine;dihydrochloride.
Chemical Property Profile of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)
Property Insights of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)
The XLogP value of 3.0524 indicates that 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 185.0 Ų indicates high polarity, suggesting 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) has 6 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)?
The CAS number of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) is 18915-16-7.
What is the molecular formula of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)?
The molecular formula of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) is C22H30Cl2N10S.
What is the molecular weight of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)?
The molecular weight of 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) is 536.18 g/mol.
Where can I buy 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)?
You can request a quote for 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2)?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triazine-2,4-diamine, 1,1'-(thiodi-4,1-phenylene)bis(1,6-dihydro-6,6-dimethyl-, hydrochloride, hydrate (1:2:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.