N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide
TL;DR: N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide (CAS 5446-49-1) is a chemical compound with molecular formula C13H11N3O6S and molecular weight 337.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide
Also Known As: N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide
| Molecular Formula | C13H11N3O6S |
|---|---|
| Molecular Weight | 337.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.03687 |
| Heavy Atoms | 23 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 5446-49-1 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NN=CC2=C(C=C(C=C2)O)O |
| InChIKey | RWTBLBUYJXPYAO-UHFFFAOYSA-N |
Product Overview
N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide (CAS 5446-49-1), with molecular formula C13H11N3O6S and molecular weight 337.04 g/mol. IUPAC: N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide.
Chemical Property Profile of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide
Property Insights of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide. The TPSA of 153.0 Ų indicates high polarity, suggesting N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide has 3 hydrogen bond donor(s) and 8 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 N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide?
The CAS number of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide is 5446-49-1.
What is the molecular formula of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide?
The molecular formula of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide is C13H11N3O6S.
What is the molecular weight of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide?
The molecular weight of N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide is 337.04 g/mol.
Where can I buy N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide?
You can request a quote for N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2,4-dihydroxyphenyl)methylideneamino]-4-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.