4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide
TL;DR: 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide (CAS 6289-99-2) is a chemical compound with molecular formula C16H15N3O4S and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide
Also Known As: 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide, 4-nitro-N-[(Z)-[(E)-4-phenylbut-3-en-2-ylidene]amino]benzene
| Molecular Formula | C16H15N3O4S |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.07834 |
| Heavy Atoms | 24 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 6289-99-2 |
|---|---|
| SMILES | CC(=NNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])C=CC2=CC=CC=C2 |
| InChIKey | QJPWWLHVQGVEDY-UHFFFAOYSA-N |
Product Overview
4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide (CAS 6289-99-2), with molecular formula C16H15N3O4S and molecular weight 345.08 g/mol. IUPAC: 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide.
Chemical Property Profile of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide
Property Insights of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide
The XLogP value of 3.0 indicates that 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide. Following Lipinski's Rule of Five, 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide 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-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide?
The CAS number of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide is 6289-99-2.
What is the molecular formula of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide?
The molecular formula of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide is C16H15N3O4S.
What is the molecular weight of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide?
The molecular weight of 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide is 345.08 g/mol.
Where can I buy 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide?
You can request a quote for 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-(4-phenylbut-3-en-2-ylideneamino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.