1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-
TL;DR: 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- (CAS 111422-31-2) is a chemical compound with molecular formula C12H21F2N5S and molecular weight 305.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(difluoromethylsulfanyl)-4-N-pentyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
Also Known As: 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-, 6-[(difluoromethyl)sulfanyl]-n-pentyl-n'-(propan-2-yl)-1,3,5-triazine-2,4-diamine, 6-(difluoromethylsulfanyl)-4-N-pentyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine, 6-(difluoromethylsulfanyl)-N'-pentyl-N-propan-2-yl-1,3,5-triazine-2,4-diamine, 6-[(Difluoromethyl)sulfanyl]-N~4~-pentyl-N~2~-(propan-2-yl)-1,3,5-triazine-2,4(1H,3H)-diimine
| Molecular Formula | C12H21F2N5S |
|---|---|
| Molecular Weight | 305.15 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 88.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 305.14856 |
| Heavy Atoms | 20 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 111422-31-2 |
|---|---|
| SMILES | CCCCCNC1=NC(=NC(=N1)SC(F)F)NC(C)C |
| InChIKey | VFLVYPNSSZKAJP-UHFFFAOYSA-N |
Product Overview
1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- (CAS 111422-31-2), with molecular formula C12H21F2N5S and molecular weight 305.15 g/mol. IUPAC: 6-(difluoromethylsulfanyl)-4-N-pentyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-
Property Insights of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-
The XLogP value of 5.2 indicates that 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- has 2 hydrogen bond donor(s) and 8 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, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-?
The CAS number of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is 111422-31-2.
What is the molecular formula of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-?
The molecular formula of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is C12H21F2N5S.
What is the molecular weight of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-?
The molecular weight of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is 305.15 g/mol.
Where can I buy 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-?
You can request a quote for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- 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, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.