3N-320S
TL;DR: 3N-320S (CAS 338416-44-7) is a chemical compound with molecular formula C20H16F3NO3S and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(4-methylsulfonylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbaldehyde
Also Known As: 3N-320S, 2-methyl-5-[4-(methylsulfonyl)phenyl]-1-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carbaldehyde, 2-methyl-5-(4-methylsulfonylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbaldehyde, 5-(4-methanesulfonylphenyl)-2-methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carbaldehyde
| Molecular Formula | C20H16F3NO3S |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 4.68752 |
| Topological Polar Surface Area | 56.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.0803 |
| Heavy Atoms | 28 |
| Complexity | 1144.4293 |
Chemical Identifiers
| CAS Number | 338416-44-7 |
|---|---|
| SMILES | CC1=C(C=C(N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)C=O |
Product Overview
3N-320S (CAS 338416-44-7), with molecular formula C20H16F3NO3S and molecular weight 407.08 g/mol. IUPAC: 2-methyl-5-(4-methylsulfonylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carbaldehyde.
Chemical Property Profile of 3N-320S
Property Insights of 3N-320S
The XLogP value of 4.68752 indicates that 3N-320S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.14 Ų, 3N-320S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3N-320S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3N-320S?
The CAS number of 3N-320S is 338416-44-7.
What is the molecular formula of 3N-320S?
The molecular formula of 3N-320S is C20H16F3NO3S.
What is the molecular weight of 3N-320S?
The molecular weight of 3N-320S is 407.08 g/mol.
Where can I buy 3N-320S?
You can request a quote for 3N-320S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3N-320S?
Yes, KEHONG BIO provides custom synthesis services for 3N-320S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.