4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl
TL;DR: 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl (CAS 21316-35-8) is a chemical compound with molecular formula C23H31FN6O6S2 and molecular weight 570.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-methylpropanoyl]amino]benzenesulfonyl fluoride;ethanesulfonic acid
Also Known As: 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl, 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-methylpropanoyl]amino]benzenesulfonyl fluoride; ethanesulfonic acid, 4-[[3-[4-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-methylpropanoyl]amino]benzenesulfonyl fluoride;ethanesulfonic acid, Ethanesulfonic acid--4-{3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]-2-methylpropanamido}benzene-1-sulfonyl fluoride (1/1)
| Molecular Formula | C23H31FN6O6S2 |
|---|---|
| Molecular Weight | 570.17 g/mol |
| LogP | 2.2417 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 570.17303 |
| Heavy Atoms | 38 |
| Complexity | 958.0 |
Chemical Identifiers
| CAS Number | 21316-35-8 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC(CC1=CC=C(C=C1)N2C(=NC(=NC2(C)C)N)N)C(=O)NC3=CC=C(C=C3)S(=O)(=O)F |
| InChIKey | HOWJVMGXEFRANV-UHFFFAOYSA-N |
Product Overview
4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl (CAS 21316-35-8), with molecular formula C23H31FN6O6S2 and molecular weight 570.17 g/mol. IUPAC: 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-methylpropanoyl]amino]benzenesulfonyl fluoride;ethanesulfonic acid.
Chemical Property Profile of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl
Property Insights of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl
The XLogP value of 2.2417 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl. The TPSA of 214.0 Ų indicates high polarity, suggesting 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl has 4 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 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl?
The CAS number of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl is 21316-35-8.
What is the molecular formula of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl?
The molecular formula of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl is C23H31FN6O6S2.
What is the molecular weight of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl?
The molecular weight of 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl is 570.17 g/mol.
Where can I buy 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl?
You can request a quote for 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl?
Yes, KEHONG BIO provides custom synthesis services for 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.