银胶菊素
TL;DR: 银胶菊素 (CAS 508-59-8) is a chemical compound with molecular formula C20H31ClN6O5S and molecular weight 502.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
银胶菊素
2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-piperidin-1-ylethanone;ethanesulfonic acid
Also Known As: ethanesulfonic acid- 2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]-1-(piperidin-1-yl)ethanone(1:1), 2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-(1-piperidyl)ethanone, 2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-piperidin-1-ylethanone; ethanesulfonic acid, 2-[2-Chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-piperidin-1-ylethanone;ethanesulfonic acid, Ethanesulfonic acid--2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]-1-(piperidin-1-yl)ethan-1-one (1/1)
| Molecular Formula | C20H31ClN6O5S |
|---|---|
| Molecular Weight | 502.18 g/mol |
| LogP | 1.8109 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 502.1765 |
| Heavy Atoms | 33 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 508-59-8 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC(=C(C=C2)OCC(=O)N3CCCCC3)Cl)N)N)C |
| InChIKey | XVUKHBLMOCGFMO-UHFFFAOYSA-N |
Product Overview
银胶菊素 (CAS 508-59-8), with molecular formula C20H31ClN6O5S and molecular weight 502.18 g/mol. IUPAC: 2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-piperidin-1-ylethanone;ethanesulfonic acid.
Chemical Property Profile of 银胶菊素
Property Insights of 银胶菊素
The XLogP value of 1.8109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 银胶菊素. The TPSA of 172.0 Ų indicates high polarity, suggesting 银胶菊素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 银胶菊素 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 银胶菊素?
The CAS number of 银胶菊素 is 508-59-8.
What is the molecular formula of 银胶菊素?
The molecular formula of 银胶菊素 is C20H31ClN6O5S.
What is the molecular weight of 银胶菊素?
The molecular weight of 银胶菊素 is 502.18 g/mol.
Where can I buy 银胶菊素?
You can request a quote for 银胶菊素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 银胶菊素?
Yes, KEHONG BIO provides custom synthesis services for 银胶菊素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.