Benzenesulfonyl fluoride der.
TL;DR: Benzenesulfonyl fluoride der. (CAS 19255-49-3) is a chemical compound with molecular formula C22H29FN6O6S2 and molecular weight 556.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
Also Known As: Benzenesulfonyl fluoride der., 4-[3-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]benzenesulfonyl fluoride; ethanesulfonic acid, ethanesulfonic acid- 4-({3-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenyl]propanoyl}amino)benzenesulfonyl fluoride(1:1), 1-[((4-Fluorosulfonyl-phenylaminocarbonyl)ethylene)phen-3-yl]-4,6-, 4-[3-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]
| Molecular Formula | C22H29FN6O6S2 |
|---|---|
| Molecular Weight | 556.16 g/mol |
| LogP | 1.9957 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 556.1574 |
| Heavy Atoms | 37 |
| Complexity | 936.0 |
Chemical Identifiers
| CAS Number | 19255-49-3 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC=CC(=C2)CCC(=O)NC3=CC=C(C=C3)S(=O)(=O)F)N)N)C |
| InChIKey | ZWVDAAYQKAPMLQ-UHFFFAOYSA-N |
Product Overview
Benzenesulfonyl fluoride der. (CAS 19255-49-3), with molecular formula C22H29FN6O6S2 and molecular weight 556.16 g/mol. IUPAC: 4-[3-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]benzenesulfonyl fluoride;ethanesulfonic acid.
Chemical Property Profile of Benzenesulfonyl fluoride der.
Property Insights of Benzenesulfonyl fluoride der.
The XLogP value of 1.9957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonyl fluoride der.. The TPSA of 214.0 Ų indicates high polarity, suggesting Benzenesulfonyl fluoride der. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenesulfonyl fluoride der. 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 Benzenesulfonyl fluoride der.?
The CAS number of Benzenesulfonyl fluoride der. is 19255-49-3.
What is the molecular formula of Benzenesulfonyl fluoride der.?
The molecular formula of Benzenesulfonyl fluoride der. is C22H29FN6O6S2.
What is the molecular weight of Benzenesulfonyl fluoride der.?
The molecular weight of Benzenesulfonyl fluoride der. is 556.16 g/mol.
Where can I buy Benzenesulfonyl fluoride der.?
You can request a quote for Benzenesulfonyl fluoride der. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonyl fluoride der.?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonyl fluoride der. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.