5G-312S
TL;DR: 5G-312S (CAS 318469-25-9) is a chemical compound with molecular formula C20H14ClF6N3O4S and molecular weight 541.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenyl]sulfonylpyrazol-4-yl]methyl N-(4-chlorophenyl)carbamate
Also Known As: 5G-312S, (1-methyl-3-(trifluoromethyl)-5-{[3-(trifluoromethyl)phenyl]sulfonyl}-1H-pyrazol-4-yl)methyl N-(4-chlorophenyl)carbamate, [1-methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenyl]sulfonylpyrazol-4-yl]methyl N-(4-chlorophenyl)carbamate, [1-methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)benzenesulfonyl]-1H-pyrazol-4-yl]methyl N-(4-chlorophenyl)carbamate, (1-METHYL-3-(TRIFLUOROMETHYL)-5-([3-(TRIFLUOROMETHYL)PHENYL]SULFONYL)-1H-PYRAZOL-4-YL)METHYL N-(4-CHLOROPHENYL)CARBAMATE
| Molecular Formula | C20H14ClF6N3O4S |
|---|---|
| Molecular Weight | 541.03 g/mol |
| LogP | 5.6926 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 541.0298 |
| Heavy Atoms | 35 |
| Complexity | 1352.66 |
Chemical Identifiers
| CAS Number | 318469-25-9 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)COC(=O)NC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F |
Product Overview
5G-312S (CAS 318469-25-9), with molecular formula C20H14ClF6N3O4S and molecular weight 541.03 g/mol. IUPAC: [1-methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenyl]sulfonylpyrazol-4-yl]methyl N-(4-chlorophenyl)carbamate.
Chemical Property Profile of 5G-312S
Property Insights of 5G-312S
The XLogP value of 5.6926 indicates that 5G-312S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 5G-312S. Following Lipinski's Rule of Five, 5G-312S has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5G-312S?
The CAS number of 5G-312S is 318469-25-9.
What is the molecular formula of 5G-312S?
The molecular formula of 5G-312S is C20H14ClF6N3O4S.
What is the molecular weight of 5G-312S?
The molecular weight of 5G-312S is 541.03 g/mol.
Where can I buy 5G-312S?
You can request a quote for 5G-312S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5G-312S?
Yes, KEHONG BIO provides custom synthesis services for 5G-312S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.