4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride
TL;DR: 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride (CAS 19188-65-9) is a chemical compound with molecular formula C15H11FN2O5S and molecular weight 350.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(3-nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride
Also Known As: 4-[3-(3-nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride, 4-{[3-(3-nitrophenyl)acryloyl]amino}benzenesulfonyl fluoride
| Molecular Formula | C15H11FN2O5S |
|---|---|
| Molecular Weight | 350.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.03726 |
| Heavy Atoms | 24 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 19188-65-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NC2=CC=C(C=C2)S(=O)(=O)F |
| InChIKey | BTLLFNKWFUSWGY-UHFFFAOYSA-N |
Product Overview
4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride (CAS 19188-65-9), with molecular formula C15H11FN2O5S and molecular weight 350.04 g/mol. IUPAC: 4-[3-(3-nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride.
Chemical Property Profile of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride
Property Insights of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride. Following Lipinski's Rule of Five, 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride has 1 hydrogen bond donor(s) and 6 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 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride?
The CAS number of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride is 19188-65-9.
What is the molecular formula of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride?
The molecular formula of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride is C15H11FN2O5S.
What is the molecular weight of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride?
The molecular weight of 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride is 350.04 g/mol.
Where can I buy 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride?
You can request a quote for 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(3-Nitrophenyl)prop-2-enoylamino]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.